506 Known Ingredients in Total


Unique ingredients have been isolated from this plant.
Plant-Ingredients Associations were manually curated from publications or collected from other databases.



99 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC100570 C15H24 204.1878008 2.4838 3.11 6.597 0 0 0 0 3 15 1
NPC100879 C15H24 204.1878008 3.953 3.11 5.148 0 0 0 4 1 15 1
NPC100887 C16H12O7 Eupafolin 316.06 -2.3966 2.45 0.589 1 4 116.45 7 3 23 0
NPC101285 C15H24O 220.1827154 1.9144 3 4.607 1 0 12.53 3 3 16 0
NPC103497 C16H15NO2 (4Z)-2-methyl-4-(5-phenyl-1,2-oxazolidin-3-ylidene)cyclohexa-2,5-dien-1-one 253.1102787 0.4676 2.89 3.38 1 1 38.33 1 3 19 0
NPC104569 C15H26O 2-[(3R,5S,8R)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol 222.1983655 1.3215 3 4.027 1 1 20.23 1 2 16 0
NPC104688 C9H16O (Z)-non-6-enal 140.1201151 -0.2469 2.34 3.485 1 0 17.07 6 0 10 0
NPC105509 C15H24 1,1,4,7-tetramethyl-1a,2,3,4,5,6,7,7b-octahydrocyclopropa[e]azulene 204.1878008 2.051 3.11 5.835 0 0 0 0 3 15 1
NPC105557 C15H24 (3S)-3-(6-methylhept-5-en-2-yl)-6-methylidenecyclohexene 204.1878008 3.1924 3.11 6.399 0 0 0 4 1 15 1
NPC105585 C10H14O (1S,5R)-6,6-dimethylbicyclo[3.1.1]hept-3-ene-4-carbaldehyde 150.1044651 0.6818 2.45 2.803 1 0 17.07 1 1 11 0
NPC10585 C10H18O (3E)-2,5,5-trimethylhepta-3,6-dien-2-ol 154.1357652 2.2233 2.45 3.478 1 1 20.23 3 0 11 0
NPC106141 C12H14O2 Prococene I 190.1 0.856 2.56 2.789 0 0 18.46 4 2 14 0
NPC106250 C15H24O 220.1827154 1.9144 3 4.607 1 0 12.53 0 3 16 0
NPC107015 C11H24 2-methyldecane 156.1878008 -0.8482 2.67 6.538 0 0 0 7 0 11 1
NPC107111 C5H8O pent-4-enal 84.05751488 0.8055 1.9 1.359 1 0 17.07 3 0 6 0
NPC1075 C9H8O4 (Z)-3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid 180.04 -0.7993 2.01 1.141 2 3 77.76 5 1 13 0
NPC107540 C10H16O 152.1201151 0.4255 2.45 2.296 1 1 20.23 4 1 11 0
NPC108186 C58H94O27 1222.598248 -6.9052 4.87 -0.621 27 15 422.05 14 11 85 3
NPC108218 C8H10O 122.0731649 -0.1931 2.23 3.189 1 1 20.23 3 1 9 0
NPC108494 C15H26O 222.1983655 3.7014 3 4.29 1 1 20.23 12 0 16 0
NPC109813 C15H24 Beta-Caryophyllene 204.19 3.2289 3.11 6.044 0 0 0 3 2 15 1
NPC11099 C12H18 hexylbenzene 162.1408506 -1.0383 2.78 7.23 0 0 0 5 1 12 1
NPC114239 C10H16 136.1252005 1.5162 2.56 4.177 0 0 0 3 1 10 0
NPC115170 C28H32O16 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one 624.1690349 -5.7305 2.78 -1.098 11 9 254.52 7 5 44 2
NPC117493 C20H40O (7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-ol 296.3079159 1.7816 3.55 8.949 1 1 20.23 13 0 21 2
NPC11780 C10H16O (1S,4R,5R)-4,6,6-trimethylbicyclo[3.1.1]heptan-3-one 152.1201151 0.702 2.45 2.434 1 0 17.07 0 1 11 0
NPC118534 C22H22O12 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one 478.1111261 -4.4836 2.56 -0.264 7 7 195.6 5 4 34 1
NPC118823 C15H24 (1S,4E,8E,10R)-4,8,11,11-tetramethylbicyclo[8.1.0]undeca-4,8-diene 204.1878008 3.2134 3.11 5.999 0 0 0 0 2 15 1
NPC119271 C12H14O4 Diethyl Phthalate 222.09 0.5232 2.34 3.18 4 0 52.6 8 1 16 0
NPC119949 C11H12O3 Elemicin 192.08 0.6742 2.34 2.486 0 0 27.69 4 2 14 0
NPC120163 C17H14O6 Cirsimaritin 314.08 -1.5278 2.67 1.642 1 2 85.22 7 3 23 0
NPC120537 C15H12O6 Getiacaulein 288.06 -1.4421 2.45 0.689 1 2 85.22 6 3 21 0
NPC120926 C15H24 Germacrene D 204.19 2.7967 3.11 6.294 0 0 0 4 1 15 1
NPC12269 C15H24 (1aS,4aR,7aS,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene 204.1878008 2.1549 3.11 6.544 0 0 0 0 3 15 1
NPC122962 C8H18O 130.1357652 -1.8481 2.23 2.807 1 1 20.23 8 0 9 0
NPC123229 C15H26O (4R,7S)-1,1,4,7-tetramethyl-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulen-4-ol 222.1983655 1.2587 3 5.078 1 1 20.23 0 3 16 1
NPC124226 C12H10 hexa-1,3-diynylbenzene 154.0782503 1.4877 2.78 5.908 0 0 0 0 1 12 1
NPC124318 C6H12O2 hexanoic acid 116.0837296 -1.0177 1.9 1.88 2 1 37.3 4 0 8 0
NPC124436 C7H8O P-Cresol 108.06 0.1817 2.12 2.367 0 1 20.23 2 1 8 0
NPC124876 C15H24 204.1878008 1.0459 3.11 6.544 0 0 0 1 3 15 1
NPC124885 C15H24 (1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,6,8a-hexahydronaphthalene 204.1878008 2.407 3.11 5.897 0 0 0 1 2 15 1
NPC125062 C16H12O7 Isorhamnetin 316.06 -2.3927 2.45 1.471 2 4 116.45 7 3 23 0
NPC125085 C10H16O (2S,5S)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one 152.1201151 1.4248 2.45 1.982 1 0 17.07 1 1 11 0
NPC125144 C7H7NO 121.0527638 -0.1505 2.01 3.323 0 1 32.59 2 1 9 0
NPC125175 C24H26O12 5-hydroxy-6,7-dimethoxy-2-[3-methoxy-4-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one 506.1424263 -3.3265 2.78 0.09 6 5 173.6 7 4 36 0
NPC125935 C30H50O2 (3S,14bR)-8a-(hydroxymethyl)-4,4,6a,6a,11,11,14b-heptamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-ol 442.3810808 2.3729 4.54 9.165 2 2 40.46 1 5 32 1
NPC125945 C12H14O 6-phenylhex-4-yn-2-ol 174.1044651 0.6496 2.67 4.357 1 1 20.23 2 1 13 0
NPC126004 C16H12O7 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-olate 315.0504777 -2.7265 2.45 1.471 2 3 119.28 2 3 23 0
NPC126240 C12H20O2 [(1R,3S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] acetate 196.1463299 1.3223 2.56 3.474 2 0 26.3 2 2 14 0
NPC12845 C15H26O (1R,4R,4aS,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol 222.1983655 1.3641 3 4.476 1 1 20.23 1 2 16 0
NPC128825 C8H8O3 Methyl Salicylate 152.05 -0.4491 2.01 2.585 2 1 46.53 4 1 11 0
NPC129588 C8H8O2 2-hydroxy-1-phenylethanone 136.0524295 -0.9259 2.12 1.894 2 1 37.3 2 1 10 0
NPC130209 C10H16O [(4R)-4-Prop-1-En-2-Ylcyclohexen-1-Yl]Methanol 152.12 1.0517 2.45 1.848 1 1 20.23 4 1 11 0
NPC130306 C10H16O 3,3,6-trimethylhepta-1,5-dien-4-one 152.1201151 2.8074 2.45 2.629 1 0 17.07 3 0 11 0
NPC131431 C10H18O (1R,4S)-1-methyl-4-propan-2-ylcyclohex-2-en-1-ol 154.1357652 0.9401 2.45 2.77 1 1 20.23 1 1 11 0
NPC131769 C15H26O (1S,4S)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol 222.1983655 1.3641 3 4.476 1 1 20.23 1 2 16 0
NPC131981 C10H16O Camphor 152.12 0.9693 2.45 2.127 1 0 17.07 3 2 11 0
NPC133513 C14H24O2 (1R,4R,5S)-5-ethenyl-2-(2-hydroxypropan-2-yl)-4-prop-1-en-2-ylcyclohexan-1-ol 224.17763 1.156 2.78 3.276 2 2 40.46 3 1 16 0
NPC134590 C10H14O (1R,5S)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-3-en-2-one 150.1044651 0.9371 2.45 1.465 1 0 17.07 1 2 11 0
NPC134969 C15H10O5 270.0528234 -1.451 2.56 3.091 2 3 86.99 4 3 20 0
NPC135088 C21H20O12 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one 464.0954761 -4.8921 2.45 -0.354 7 8 206.6 4 4 33 1
NPC135238 C10H16 6,7,7-trimethyl-2,3,4,5-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptane 136.1252005 0.9365 2.56 4.779 0 0 0 0 1 10 0
NPC13789 C15H24O (-)-Caryophyllene Oxide 220.18 1.9144 3 4.607 1 0 12.53 3 3 16 0
NPC137949 C9H6O4 Esculetin 178.03 -0.6506 2.01 0.998 1 2 66.76 2 2 13 0
NPC138021 C21H24O6 (3R,4R)-3-[(3,4-dimethoxyphenyl)methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one 372.1572885 -0.5036 3.11 2.934 2 1 74.22 7 3 27 0
NPC138113 C10H16 Myrcene 136.13 3.0936 2.56 4.17 0 0 0 6 0 10 0
NPC138347 C15H24O 1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol 220.1827154 1.7158 3 4.157 1 1 20.23 0 3 16 0
NPC138586 C18H30O octadeca-9,12,15-trienal 262.2296656 -0.0505 3.33 7.952 1 0 17.07 13 0 19 2
NPC138811 C28H32O14 Acaciin 592.18 -4.4698 3 0.144 10 7 214.06 16 5 42 1
NPC139546 C10H18O (3S)-3,7-dimethylocta-1,6-dien-3-ol 154.1357652 2.4692 2.45 2.468 1 1 20.23 4 0 11 0
NPC139891 C9H6O2 Coumarin 146.04 0.27 2.23 2.706 1 0 26.3 0 2 11 0
NPC13991 C10H16 Alpha-Pinene 136.13 1.5162 2.56 4.177 0 0 0 3 1 10 0
NPC141777 C10H16 136.1252005 1.3875 2.56 4.024 0 0 0 2 2 10 0
NPC143639 C15H24O (4aS,7R,7aR)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol 220.1827154 1.7158 3 4.157 1 1 20.23 0 3 16 0
NPC143799 C16H12O6 300.0633881 -1.9324 2.56 2.434 2 3 96.22 6 3 22 0
NPC14426 C10H16O [(1S,5R)-6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]methanol 152.1201151 0.4255 2.45 2.296 1 1 20.23 1 1 11 0
NPC144719 C10H18O (4S)-3,3,6-trimethylhepta-1,5-dien-4-ol 154.1357652 2.6672 2.45 2.283 1 1 20.23 3 0 11 0
NPC145038 C21H20O12 2-(3,4-Dihydroxyphenyl)-5,7-Dihydroxy-3-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxychromen-4-One 464.1 -4.8921 2.45 -0.354 7 8 206.6 12 4 33 1
NPC14576 C15H24 204.1878008 1.0459 3.11 6.544 0 0 0 1 3 15 1
NPC146197 C18H34O2 (Z)-9,10-dideuteriooctadec-9-enoic acid 282.2558803 -2.3427 3.22 8.192 2 1 37.3 15 0 20 2
NPC146679 C17H14O6 Kumatakenin 314.08 -1.8679 2.67 2.326 2 2 85.22 7 3 23 0
NPC14682 C10H18O (1S,4S)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol 154.1357652 0.9432 2.45 2.734 1 1 20.23 0 2 11 0
NPC147062 C8H10 M-Xylene 106.08 1.284 2.34 4.708 0 0 0 2 1 8 0
NPC148163 C10H16O 152.1201151 1.0517 2.45 1.848 1 1 20.23 4 1 11 0
NPC148216 C10H16O (4-Prop-1-En-2-Ylcyclohexen-1-Yl)Methanol 152.12 1.0517 2.45 1.848 1 1 20.23 4 1 11 0
NPC14917 C10H16O 152.1201151 1.583 2.45 2.126 1 0 17.07 3 1 11 0
NPC150329 C15H24 (1S,4aR,8aR)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene 204.1878008 2.2603 3.11 5.942 0 0 0 1 2 15 1
NPC150643 C15H24 4,6-dimethyl-6-(4-methylpent-3-enyl)bicyclo[3.1.1]hept-3-ene 204.1878008 2.7484 3.11 6.104 0 0 0 3 1 15 1
NPC151500 C22H22O12 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one 478.1111261 -4.4836 2.56 -0.264 7 7 195.6 5 4 34 1
NPC15336 C25H24O12 (3S,5S)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acid 516.1267762 -2.3865 2.89 1.085 8 7 211.28 9 3 37 1
NPC154186 C15H30O2 242.2245802 -3.6097 2.89 7.001 2 1 37.3 15 0 17 2
NPC154466 C10H16O (1S,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ol 152.1201151 1.5693 2.45 1.699 1 1 20.23 1 1 11 0
NPC154792 C11H12O4 (Z)-3-(3,4-dimethoxyphenyl)prop-2-enoic acid 208.0735589 0.0177 2.23 1.75 2 1 55.76 4 1 15 0
NPC155182 C15H24 (6Z)-7,11-dimethyl-3-methylidenedodeca-1,6,10-triene 204.1878008 4.3258 3.11 5.992 0 0 0 7 0 15 1
NPC156222 C17H14O6 Pectolinarigenin 314.08 -1.5278 2.67 1.642 1 2 85.22 7 3 23 0
NPC156630 C8H16O2.Na 143.1072047 -2.2715 2.12 2.537 2 0 40.13 8 0 10 0
NPC156768 C6H8O 96.05751488 -0.3908 2.01 1.873 0 0 13.14 2 1 7 0
NPC156784 C10H16O (1R,4R,5R)-4,6,6-trimethylbicyclo[3.1.1]heptan-3-one 152.1201151 0.702 2.45 2.434 1 0 17.07 0 1 11 0
NPC157898 C23H24O10 460.14 -2.6514 2.89 1.759 7 5 162.98 14 3 33 0
NPC158243 C29H44O7 4-ethyl-6-[1-hydroxy-1-[(2S,3R,5R,10R,13R,17S)-2,3,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethyl]-3-methyloxan-2-one 504.3087037 -0.9228 3.88 2.611 7 4 124.29 3 5 36 0
NPC159242 C58H94O27 1222.598248 -6.9052 4.87 -0.621 27 15 422.05 14 11 85 3
NPC16070 C10H14O 6,6-dimethylbicyclo[3.1.1]hept-3-ene-4-carbaldehyde 150.1044651 0.6818 2.45 2.803 1 0 17.07 1 1 11 0
NPC160996 C15H24O (1R,4E,8E,11R)-4,7,7,11-tetramethyl-12-oxabicyclo[9.1.0]dodeca-4,8-diene 220.1827154 2.4043 3 4.314 1 0 12.53 0 2 16 0
NPC161555 C8H16O (3S)-oct-1-en-3-ol 128.1201151 -0.9039 2.23 2.707 1 1 20.23 5 0 9 0
NPC16157 C15H24O 220.1827154 1.9144 3 4.607 1 0 12.53 0 3 16 0
NPC162313 C16H12O7 2-(3,4-Dihydroxyphenyl)-5,6-Dihydroxy-7-Methoxychromen-4-One 316.06 -2.3966 2.45 1.018 1 4 116.45 7 3 23 0
NPC162737 C12H14 [(2E,4E)-hexa-2,4-dienyl]benzene 158.1095504 1.6963 2.78 6.375 0 0 0 3 1 12 1
NPC163984 C10H14O (S)(+)Carvone 150.1 1.5954 2.45 1.756 1 0 17.07 3 1 11 0
NPC164700 C57H110O6 2,3-di(octadecanoyloxy)propyl octadecanoate 890.8302412 -13.0022 7.07 26.704 6 0 78.9 56 0 63 2
NPC164721 C15H24 204.1878008 2.4838 3.11 6.597 0 0 0 0 3 15 1
NPC16483 C21H21NO6 383.1368874 -1.3349 3 1.16 2 1 69.62 1 6 28 0
NPC165525 C10H18O 2-(4-methylidenecyclohexyl)propan-2-ol 154.1357652 0.9756 2.45 2.414 1 1 20.23 1 1 11 0
NPC1656 C10H18O2 2-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol 170.1306798 0.759 2.34 1.559 2 1 29.46 2 1 12 0
NPC165651 C10H20O 156.1514153 1.4641 2.45 3.286 1 1 20.23 9 0 11 0
NPC166362 C10H16 136.1252005 1.3875 2.56 4.024 0 0 0 2 2 10 0
NPC166692 C15H24 (3Z,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene 204.1878008 4.4725 3.11 6.136 0 0 0 6 0 15 1
NPC166894 C10H18O 154.1357652 0.9432 2.45 2.734 1 1 20.23 4 2 11 0
NPC167976 C16H18O9 (1S,3R,4R,5R)-3-[(Z)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid 354.0950822 -2.1962 2.23 -0.447 7 6 164.75 5 2 25 1
NPC168855 C10H14O 150.1044651 0.7758 2.45 3.609 1 1 20.23 5 1 11 0
NPC172204 C20H23NO4 (13aS)-3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-2,9-diol 342.1705332 -2.075 3.11 1.319 0 2 58.92 2 4 25 0
NPC173208 C27H30O16 3-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one 610.1533849 -5.7198 2.67 -1.987 11 9 254.52 7 5 43 2
NPC173996 C10H16O 4,7,7-Trimethylbicyclo[2.2.1]Heptan-3-One 152.12 0.9693 2.45 2.127 1 0 17.07 3 2 11 0
NPC174665 C10H16O (1S,4S,5S)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one 152.1201151 0.5558 2.45 2.434 1 0 17.07 1 2 11 0
NPC175122 C10H16O (1R,3R,6S)-6-methyl-3-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptane 152.1201151 1.5647 2.45 2.292 1 0 12.53 1 2 11 0
NPC175987 C15H24 (4Z)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene 204.1878008 3.2289 3.11 6.044 0 0 0 0 2 15 1
NPC176740 C27H30O16 Rutin 610.15 -6.139 2.67 -1.188 11 10 265.52 17 5 43 2
NPC176819 C10H14O 150.1044651 1.5954 2.45 1.756 1 0 17.07 3 1 11 0
NPC17697 C8H14O2 propan-2-yl 3-methylbut-2-enoate 142.0993797 1.4106 2.12 2.002 2 0 26.3 3 0 10 0
NPC177112 C10H18O 154.1357652 1.1223 2.45 1.947 1 1 20.23 5 1 11 0
NPC178223 C10H18O 154.1357652 0.9432 2.45 2.734 1 1 20.23 4 2 11 0
NPC178638 C11H18O2 [(1E)-2,6-dimethylhepta-1,5-dienyl] acetate 182.1306798 2.1862 2.45 2.68 2 0 26.3 5 0 13 0
NPC1788 C9H8O4 4-(2-carboxyethenyl)-2-hydroxyphenolate 179.0344337 -1.1331 2.01 1.141 2 2 80.59 2 1 13 0
NPC179103 C16H32 224.250401 -2.4416 3.22 9.078 0 0 0 14 0 16 2
NPC179165 C12H18O2 [(1S,5R)-4,6,6-trimethyl-7-bicyclo[3.1.1]hept-3-enyl] acetate 194.1306798 1.3222 2.56 2.621 2 0 26.3 2 1 14 0
NPC179950 C21H20O12 Isoquercetin 464.1 -4.8921 2.45 -0.354 7 8 206.6 12 4 33 1
NPC180058 C8H8O3 2,3,6-trideuterio-4-hydroxy-5-methoxybenzaldehyde 152.0473441 -0.7045 2.01 1.04 1 1 46.53 2 1 11 0
NPC180684 C10H18O (1S,3S,4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol 154.1357652 0.9432 2.45 2.734 1 1 20.23 0 2 11 0
NPC180871 C10H18O Linalool 154.14 2.4692 2.45 2.468 1 1 20.23 8 0 11 0
NPC180968 C12H8O 1-phenylhexa-2,4-diyn-1-one 168.0575149 1.559 2.67 4.462 1 0 17.07 1 1 13 0
NPC181153 C3H6O2 74.03677943 -0.1537 1.57 0.173 2 1 37.3 3 0 5 0
NPC1813 C18H30O2 278.2245802 -0.0979 3.22 7.538 2 1 37.3 15 0 20 2
NPC181516 C16H34O Cetyl Alcohol 242.26 -4.4294 3.11 7.679 1 1 20.23 16 0 17 2
NPC18205 C10H16O Citral 152.12 2.4893 2.45 2.701 1 0 17.07 7 0 11 0
NPC182102 C20H40O 296.3079159 1.7816 3.55 8.949 1 1 20.23 19 0 21 2
NPC182158 C15H24 204.1878008 2.4838 3.11 6.597 0 0 0 0 3 15 1
NPC182315 C10H16O 3,5,5-trimethylbicyclo[2.2.1]heptan-2-one 152.1201151 1.1498 2.45 2.219 1 0 17.07 0 2 11 0
NPC182840 C10H18O Nerol 154.14 2.3397 2.45 2.524 1 1 20.23 8 0 11 0
NPC184049 C15H24O 220.1827154 1.7158 3 4.157 1 1 20.23 4 3 16 0
NPC186793 C15H24O 6-methyl-3-[(2Z)-6-methylhepta-2,5-dien-2-yl]-7-oxabicyclo[4.1.0]heptane 220.1827154 2.9436 3 4.258 1 0 12.53 3 2 16 0
NPC187025 C15H10O6 5,7-dihydroxy-2-(4-hydroxyphenoxy)chromen-4-one 286.047738 -1.5825 2.45 1.957 1 3 96.22 2 3 21 0
NPC187145 C20H19N3O2 3-(1H-Benzimidazol-2-Yl)-7-(Diethylamino)Chromen-2-One 333.15 0.4793 3.11 4.231 4 1 58.22 6 4 25 0
NPC187796 C10H16O (1S,4R,5S)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one 152.1201151 0.5558 2.45 2.434 1 0 17.07 1 2 11 0
NPC187880 C8H13NO2 155.0946287 -1.3269 2.01 -0.565 3 1 36 0 3 11 0
NPC188238 C10H18O (1S)-4-methyl-1-propan-2-ylcyclohex-3-en-1-ol 154.1357652 1.1223 2.45 1.947 1 1 20.23 1 1 11 0
NPC189036 C10H18O (1R,3R,4S)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol 154.1357652 0.9432 2.45 2.734 1 1 20.23 0 2 11 0
NPC189318 C12H22O2 [(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl] acetate 198.1619799 1.0354 2.56 3.951 2 0 26.3 3 1 14 0
NPC189331 C18H30O (9E,12E,15E)-octadeca-9,12,15-trienal 262.2296656 -0.0505 3.33 7.952 1 0 17.07 13 0 19 2
NPC189853 C15H24 8a-methyl-5-methylidene-3-prop-1-en-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene 204.1878008 1.7182 3.11 6.19 0 0 0 1 2 15 1
NPC19003 C10H16O (2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one 152.1201151 1.4248 2.45 1.982 1 0 17.07 1 1 11 0
NPC190771 C10H16O (2Z)-3,7-dimethylocta-2,6-dienal 152.1201151 2.4893 2.45 2.701 1 0 17.07 4 0 11 0
NPC190810 C10H16 136.1252005 2.1424 2.56 3.729 0 0 0 3 1 10 0
NPC192350 C17H14O7 3,5-dihydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxychromen-4-one 330.0739528 -1.9842 2.56 1.99 2 3 105.45 3 3 24 0
NPC192962 C15H26O 222.1983655 1.3215 3 4.027 1 1 20.23 6 2 16 0
NPC193180 C15H24 204.1878008 1.7182 3.11 6.19 0 0 0 3 2 15 1
NPC19319 C10H18O 4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-4-ol 154.1357652 0.5023 2.45 2.756 1 1 20.23 1 2 11 0
NPC194586 C15H26O Nerolidiol 222.2 3.7014 3 4.29 1 1 20.23 12 0 16 0
NPC194626 C13H16O3 Prococene Ii 220.11 0.8042 2.56 2.345 0 0 27.69 6 2 16 0
NPC195717 C15H24 (1S,5S)-4,6-dimethyl-6-(4-methylpent-3-enyl)bicyclo[3.1.1]hept-3-ene 204.1878008 2.7484 3.11 6.104 0 0 0 3 1 15 1
NPC195785 C15H18O3 3,6,9-Trimethyl-3,3A,4,5,9A,9B-Hexahydroazuleno[4,5-B]Furan-2,7-Dione 246.13 1.2966 2.78 1.131 3 0 43.37 3 3 18 0
NPC19604 C15H24O (1Z,7R,8R)-7-methyl-4-propan-2-ylidenebicyclo[5.3.1]undec-1-en-8-ol 220.1827154 2.0709 3 3.195 1 1 20.23 0 2 16 0
NPC196081 C12H14O3 2-[(4-methoxyphenyl)methylidene]butanoate 205.0864693 -0.3903 2.45 2.569 2 0 49.36 4 1 15 0
NPC196490 C10H18O (3R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol 154.1357652 0.9432 2.45 2.734 1 1 20.23 0 2 11 0
NPC196711 C15H24O (4Z,8Z)-4,7,7,11-tetramethyl-12-oxabicyclo[9.1.0]dodeca-4,8-diene 220.1827154 2.4043 3 4.314 1 0 12.53 0 2 16 0
NPC197356 C6H12O 100.088815 -0.5056 2.01 1.473 1 1 20.23 5 0 7 0
NPC197783 C8H10O 122.0731649 -0.1534 2.23 2.936 0 1 20.23 3 1 9 0
NPC197977 C8H18O (3S)-octan-3-ol 130.1357652 -1.8481 2.23 2.807 1 1 20.23 5 0 9 0
NPC198023 C15H22 202.1721507 2.8428 3.11 7.712 0 0 0 8 1 15 1
NPC198658 C10H16 (3Z)-3,7-dimethylocta-1,3,6-triene 136.1252005 3.2403 2.56 4.314 0 0 0 3 0 10 0
NPC20045 C7H6O3 2-carboxyphenolate 137.023869 -1.0339 1.9 2.264 2 1 60.36 1 1 10 0
NPC202146 C15H26O 222.2 1.3573 3 5.176 1 1 20.23 5 3 16 1
NPC202189 C15H24 204.1878008 2.2115 3.11 5.46 0 0 0 5 2 15 1
NPC202397 C29H50O 414.3861662 1.3421 4.54 12.383 1 1 20.23 5 5 30 1
NPC202592 C17H14O8 2-(2,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-6-methoxychromen-4-one 346.0688674 -2.4484 2.45 -0.284 1 4 125.68 3 3 25 0
NPC202691 C15H26O (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol 222.1983655 1.3641 3 4.476 1 1 20.23 1 2 16 0
NPC203050 C22H22O12 478.1111261 -4.4836 2.56 -0.264 12 7 195.6 13 4 34 1
NPC203071 C6H14O (3S)-3-methylpentan-1-ol 102.1044651 -0.84 2.01 1.928 1 1 20.23 3 0 7 0
NPC203634 C15H24 (1Z,5E)-1,4,4-trimethyl-8-methylidenecycloundeca-1,5-diene 204.1878008 3.2873 3.11 5.985 0 0 0 0 1 15 1
NPC203719 C8H8O3 Vanillin 152.05 -0.7045 2.01 1.04 1 1 46.53 4 1 11 0
NPC204120 C12H16O3 208.1099444 0.8733 2.45 2.559 0 0 27.69 8 1 15 0
NPC204838 C15H22 2,4a,8,8-tetramethyl-1,1a,4,5-tetrahydrocyclopropa[j]naphthalene 202.1721507 3.0313 3.11 5.981 0 0 0 0 3 15 1
NPC206093 C16H12O7 5,7-dihydroxy-2-(4-hydroxyphenoxy)-6-methoxychromen-4-one 316.0583027 -1.6343 2.45 1.513 1 3 105.45 3 3 23 0
NPC206095 C25H24O12 4,5-Dicaffeoylquinic Acid 516.13 -2.3865 2.89 1.085 8 7 211.28 16 3 37 1
NPC206143 C6H14O 3-methylpentan-1-ol 102.1044651 -0.84 2.01 1.928 1 1 20.23 3 0 7 0
NPC20742 C20H40O 3,7,11,15-tetramethylhexadec-2-en-1-ol 296.3079159 1.7816 3.55 8.949 1 1 20.23 13 0 21 2
NPC20790 C15H10O7 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-olate 301.0348276 -3.135 2.34 1.381 2 4 130.28 1 3 22 0
NPC20791 C15H10O7 Quercetin 302.04 -2.8012 2.34 1.381 2 5 127.45 6 3 22 0
NPC208075 C8H8O 120.0575149 -0.1576 2.23 3.494 1 0 17.07 2 1 9 0
NPC208151 C10H16O 4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one 152.1201151 0.5558 2.45 2.434 1 0 17.07 1 2 11 0
NPC20830 C18H16O6 328.0946882 -1.1193 2.78 2.161 1 1 74.22 8 3 24 0
NPC209275 C15H24 (1S,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene 204.1878008 3.2289 3.11 6.044 0 0 0 0 2 15 1
NPC209279 C15H26O 222.1983655 3.7014 3 4.29 1 1 20.23 12 0 16 0
NPC209970 C18H36O2 Stearic Acid 284.27 -4.4737 3.22 8.708 2 1 37.3 18 0 20 2
NPC210040 C25H24O12 (3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acid 516.1267762 -2.3865 2.89 1.085 8 7 211.28 9 3 37 1
NPC210288 C15H26O 2-[(2R,4aR)-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl]propan-2-ol 222.1983655 1.5816 3 4.785 1 1 20.23 1 2 16 0
NPC210560 C10H20O 156.1514153 1.4641 2.45 3.286 1 1 20.23 9 0 11 0
NPC210831 C15H24 204.1878008 1.7635 3.11 6.499 0 0 0 1 1 15 1
NPC212070 C10H16O (1R,3S,5R)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-ol 152.1201151 0.7964 2.45 2.192 1 1 20.23 0 1 11 0
NPC213749 C10H16 136.1252005 2.4017 2.56 3.852 0 0 0 4 1 10 0
NPC214367 C12H22O2 5,9-dimethyldec-8-enoate 197.1541549 1.2856 2.56 3.834 2 0 40.13 7 0 14 0
NPC214584 C10H18O 154.1357652 1.1223 2.45 2.369 1 1 20.23 5 1 11 0
NPC214609 C10H14O 4,6,6-trimethylbicyclo[3.1.1]hept-3-en-7-one 150.1044651 1.3376 2.45 1.578 1 0 17.07 0 1 11 0
NPC214909 C15H24 (6E,8S)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene 204.1878008 2.7967 3.11 6.294 0 0 0 1 1 15 1
NPC215632 C10H16 4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-3-ene 136.1252005 1.6288 2.56 4.177 0 0 0 1 2 10 0
NPC215911 C10H18O (1S,6S)-3-methyl-6-propan-2-ylcyclohex-2-en-1-ol 154.1357652 0.9883 2.45 2.515 1 1 20.23 1 1 11 0
NPC216092 C21H22O4 9-[(2E)-3,7-Dimethylocta-2,6-Dienoxy]Furo[3,2-G]Chromen-7-One 338.15 2.7618 3.33 4.713 1 0 48.67 9 3 25 0
NPC216533 C10H18O [(1R,4S,5R)-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]methanol 154.1357652 0.3926 2.45 3.167 1 1 20.23 1 1 11 0
NPC216630 C16H32O2 Palmitic Acid 256.24 -3.8977 3 7.57 2 1 37.3 16 0 18 2
NPC218205 C14H22O 206.1670653 0.9607 2.89 3.726 1 0 17.07 0 3 15 0
NPC218634 C18H16O8 5,6-dihydroxy-2-(4-hydroxy-2,5-dimethoxyphenyl)-7-methoxychromen-4-one 360.0845175 -2.0399 2.56 0.664 1 3 114.68 4 3 26 0
NPC218918 C15H24 204.1878008 2.7967 3.11 6.294 0 0 0 4 1 15 1
NPC219733 C15H32 4,8-dimethyltridecane 212.250401 -0.0482 3.11 8.753 0 0 0 10 0 15 1
NPC220383 C11H22O2 8-methyldecanoic acid 186.1619799 -1.2047 2.45 4.664 2 1 37.3 8 0 13 0
NPC221733 C10H18O (1R,6S)-3-methyl-6-propan-2-ylcyclohex-2-en-1-ol 154.1357652 0.9883 2.45 2.515 1 1 20.23 1 1 11 0
NPC221964 C10H18O2 1-methyl-4-prop-1-en-2-ylcyclohexane-1,2-diol 170.1306798 0.7982 2.34 1.703 2 2 40.46 1 1 12 0
NPC222001 C10H16 (1S,6R)-4,7,7-trimethylbicyclo[4.1.0]hept-3-ene 136.1252005 2.1434 2.56 4.181 0 0 0 0 2 10 0
NPC22229 C10H16 (1S,5S)-4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane 136.1252005 1.0301 2.56 4.222 0 0 0 1 2 10 0
NPC222955 C10H16O (1S,4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one 152.1201151 0.9693 2.45 2.127 1 0 17.07 0 2 11 0
NPC222997 C9H18O 142.1357652 -1.6078 2.34 3.283 1 0 17.07 8 0 10 0
NPC223574 C15H24O 220.1827154 1.2672 3 4.332 1 0 17.07 0 3 16 0
NPC223697 C18H32O2 (9E,12E)-octadeca-9,12-dienoic acid 280.2402303 -0.9485 3.22 7.865 2 1 37.3 14 0 20 2
NPC224389 C25H24O12 3,4-Dicaffeoylquinic Acid 516.13 -2.3865 2.89 1.085 8 7 211.28 16 3 37 1
NPC22484 C15H24 (1R,4aR,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene 204.1878008 2.2603 3.11 5.942 0 0 0 1 2 15 1
NPC224853 C12H14O3 (2-methoxy-4-prop-1-enylphenyl) acetate 206.0942943 0.7743 2.45 3.545 1 0 35.53 4 1 15 0
NPC225221 C12H10 hexa-2,4-diynylbenzene 154.0782503 2.279 2.78 5.647 0 0 0 1 1 12 1
NPC225434 C22H22O12 Isorhamnetin 3-Glucoside 478.11 -4.4836 2.56 -0.264 7 7 195.6 13 4 34 1
NPC227049 C15H24 (4E,8E)-4,8,11,11-tetramethylbicyclo[8.1.0]undeca-4,8-diene 204.1878008 3.2134 3.11 5.999 0 0 0 0 2 15 1
NPC227378 C12H20O2 [(3S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] acetate 196.1463299 1.3223 2.56 3.474 2 0 26.3 2 2 14 0
NPC227670 C10H16 136.1252005 1.3875 2.56 4.024 0 0 0 2 2 10 0
NPC230291 C15H24 1,4-dimethyl-7-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroazulene 204.1878008 2.6467 3.11 6.048 0 0 0 1 2 15 1
NPC230301 C29H50O Beta-Sitosterol 414.39 1.3 4.54 11.595 1 1 20.23 13 4 30 1
NPC23084 C15H20O9 344.1107322 -2.9732 2.12 -0.751 6 5 145.91 12 2 24 0
NPC231738 C15H24 (4E)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene 204.1878008 3.2289 3.11 6.044 0 0 0 0 2 15 1
NPC232375 C10H16 (5S)-2-methyl-5-propan-2-ylcyclohexa-1,3-diene 136.1252005 1.7112 2.56 4.427 0 0 0 1 1 10 0
NPC232656 C15H24O 220.1827154 1.2734 3 4.531 1 0 12.53 0 4 16 0
NPC233533 C18H36O 6,10,14-trimethylpentadecan-2-one 268.2766158 1.0346 3.33 8.221 1 0 17.07 12 0 19 2
NPC233547 C10H18 (5R)-5,7-dimethylocta-1,6-diene 138.1408506 2.9083 2.56 4.681 0 0 0 4 0 10 0
NPC234133 C16H12O5 284.0684735 -1.476 2.67 2.086 1 2 75.99 5 3 21 0
NPC234704 C11H12 [(2E)-penta-2,4-dienyl]benzene 144.0939004 1.4965 2.67 5.851 0 0 0 3 1 11 1
NPC23615 C10H18O 3,3,6-trimethylhepta-1,5-dien-4-ol 154.1357652 2.6672 2.45 2.283 1 1 20.23 3 0 11 0
NPC236355 C10H16O 152.1201151 1.583 2.45 2.126 1 0 17.07 3 1 11 0
NPC236579 C18H36O2 284.2715304 -3.3963 3.22 8.314 2 0 26.3 18 0 20 2
NPC236602 C10H16O (1R,5R)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ol 152.1201151 1.5693 2.45 1.699 1 1 20.23 1 1 11 0
NPC238475 C10H14O (1R,5R)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-one 150.1044651 0.8225 2.45 2.249 1 0 17.07 0 1 11 0
NPC239037 C15H26O 1,1,4,7-tetramethyl-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulen-4-ol 222.1983655 1.2587 3 5.078 1 1 20.23 0 3 16 1
NPC239039 C10H16 136.1252005 1.8841 2.56 3.546 0 0 0 4 1 10 0
NPC240722 C11H10O4 Scoparone 206.06 0.1664 2.23 1.607 1 0 44.76 4 2 15 0
NPC240817 C15H22 1-methyl-4-(6-methylhept-5-en-2-yl)benzene 202.1721507 2.8428 3.11 7.712 0 0 0 4 1 15 1
NPC241263 C19H17NO3 307.1208434 0.1718 3.11 3.511 2 1 47.56 4 4 23 0
NPC24146 C25H24O12 3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acid 516.1267762 -2.3865 2.89 1.085 8 7 211.28 9 3 37 1
NPC241721 C9H16O (Z)-non-2-enal 140.1201151 -0.6764 2.34 3.557 1 0 17.07 6 0 10 0
NPC242314 C15H24 2-methyl-5-(6-methylhept-5-en-2-yl)cyclohexa-1,3-diene 204.1878008 3.3391 3.11 6.354 0 0 0 4 1 15 1
NPC242695 C28H32O16 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,5R)-3,4,5-trihydroxy-6-[[(2R,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one 624.1690349 -5.7305 2.78 -1.098 11 9 254.52 7 5 44 2
NPC24294 C15H24 (1aR,4R,7R,7bS)-1,1,4,7-tetramethyl-1a,2,3,4,5,6,7,7b-octahydrocyclopropa[e]azulene 204.1878008 2.051 3.11 5.835 0 0 0 0 3 15 1
NPC243295 C10H18O [(1R,4R,5R)-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]methanol 154.1357652 0.3926 2.45 3.167 1 1 20.23 1 1 11 0
NPC243677 C19H24O3 Artepillin 300.17 3.4158 3.22 4.826 2 2 57.53 12 1 22 0
NPC245552 C12H14O3 [2-Methoxy-4-[(E)-Prop-1-Enyl]Phenyl] Acetate 206.09 0.7743 2.45 3.545 1 0 35.53 7 1 15 0
NPC246165 C10H16 136.1252005 1.0301 2.56 4.222 0 0 0 3 2 10 0
NPC246358 C9H10O2 150.0680796 0.1954 2.23 2.281 0 1 29.46 4 1 11 0
NPC247553 C9H6O3 Umbelliferone 162.03 -0.1903 2.12 1.532 1 1 46.53 1 2 12 0
NPC24824 C10H20O Citronellol 156.15 1.4641 2.45 3.286 1 1 20.23 9 0 11 0
NPC248726 C15H24 7,11-dimethyl-3-methylidenedodeca-1,6,10-triene 204.1878008 4.3258 3.11 5.992 0 0 0 7 0 15 1
NPC249009 C15H24 3-(6-methylhept-5-en-2-yl)-6-methylidenecyclohexene 204.1878008 3.1924 3.11 6.399 0 0 0 4 1 15 1
NPC249234 C10H18O (1S,4S)-1-methyl-4-propan-2-ylcyclohex-2-en-1-ol 154.1357652 0.9401 2.45 2.77 1 1 20.23 1 1 11 0
NPC249801 C8H16O 128.1201151 -0.9039 2.23 2.707 1 1 20.23 7 0 9 0
NPC249808 C10H18O (1R,6R)-3-methyl-6-propan-2-ylcyclohex-2-en-1-ol 154.1357652 0.9883 2.45 2.515 1 1 20.23 1 1 11 0
NPC249815 C15H24 1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene 204.1878008 2.1549 3.11 6.544 0 0 0 0 3 15 1
NPC250194 C12H18O2 [(1S,3R,5S)-6,6-dimethyl-4-methylidene-3-bicyclo[3.1.1]heptanyl] acetate 194.1306798 1.1755 2.56 2.932 2 0 26.3 2 1 14 0
NPC250323 C20H28O 6,7-Dehydroferruginol 284.21 1.6021 3.55 8.057 0 1 20.23 7 3 21 1
NPC251490 C12H8 152.0626003 0.4678 2.78 6.46 0 0 0 0 3 12 1
NPC251666 C10H16O 152.1201151 1.5693 2.45 1.699 1 1 20.23 4 1 11 0
NPC252230 C15H24 204.1878008 1.7635 3.11 6.499 0 0 0 1 1 15 1
NPC252558 C21H20O12 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one 464.0954761 -4.8921 2.45 -0.354 7 8 206.6 4 4 33 1
NPC25270 C17H14O7 Cirsiliol 330.07 -1.9881 2.56 1.108 1 3 105.45 8 3 24 0
NPC25275 C15H24O (1R,4Z,8Z,11R)-4,7,7,11-tetramethyl-12-oxabicyclo[9.1.0]dodeca-4,8-diene 220.1827154 2.4043 3 4.314 1 0 12.53 0 2 16 0
NPC255042 C10H18O Geraniol 154.14 2.3397 2.45 2.524 1 1 20.23 8 0 11 0
NPC255577 C10H18O (1R,4R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-4-ol 154.1357652 0.5023 2.45 2.756 1 1 20.23 1 2 11 0
NPC257124 C10H12O2 Eugenol 164.08 0.5166 2.34 2.484 0 1 29.46 5 1 12 0
NPC258750 C10H16O (1R,4R,5S)-4,6,6-trimethylbicyclo[3.1.1]heptan-3-one 152.1201151 0.702 2.45 2.434 1 0 17.07 0 1 11 0
NPC259512 C10H14O Thymol 150.1 0.7546 2.45 3.556 0 1 20.23 5 1 11 0
NPC260756 C15H24 (1S,3aS,4S,7S)-1,4-dimethyl-7-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroazulene 204.1878008 2.6467 3.11 6.048 0 0 0 1 2 15 1
NPC260976 C10H14O (1R,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-7-one 150.1044651 1.3376 2.45 1.578 1 0 17.07 0 1 11 0
NPC26111 C15H24 (4Z)-1-methyl-4-(6-methylhept-5-en-2-ylidene)cyclohexene 204.1878008 3.953 3.11 5.148 0 0 0 3 1 15 1
NPC262505 C10H20O 156.1514153 -2.1223 2.45 4.57 1 0 17.07 9 0 11 0
NPC262789 C10H16 136.1252005 3.2403 2.56 4.314 0 0 0 6 0 10 0
NPC264779 C15H26O Beta-Eudesmol 222.2 0.6981 3 4.83 1 1 20.23 5 2 16 0
NPC265245 C18H16O8 2-(2,4-dihydroxy-5-methoxyphenyl)-5-hydroxy-6,7-dimethoxychromen-4-one 360.0845175 -2.0399 2.56 0.235 1 3 114.68 4 3 26 0
NPC265547 C10H8O3 Herniarin 176.05 0.2182 2.23 2.051 1 0 35.53 2 2 13 0
NPC26600 C12H20O2 Neryl Acetate 196.15 2.7188 2.56 3.264 2 0 26.3 10 0 14 0
NPC266331 C15H18O3 (3R,3aS,9aS,9bS)-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione 246.1255944 1.2966 2.78 1.131 3 0 43.37 0 3 18 0
NPC266603 C10H16O (1S,3R,5S)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-ol 152.1201151 0.7964 2.45 2.192 1 1 20.23 0 1 11 0
NPC267020 C10H18O [(1S,4S,5S)-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]methanol 154.1357652 0.3926 2.45 3.167 1 1 20.23 1 1 11 0
NPC268164 C15H24 (1R,8E,10S)-4,8,11,11-tetramethylbicyclo[8.1.0]undeca-4,8-diene 204.1878008 3.2134 3.11 5.999 0 0 0 0 2 15 1
NPC268221 C18H32O2 octadeca-9,12-dienoic acid 280.2402303 -0.9485 3.22 7.865 2 1 37.3 14 0 20 2
NPC268564 C10H16O 152.1201151 1.2899 2.45 2.238 1 0 17.07 4 1 11 0
NPC268862 C10H16 (1R,6S)-4,7,7-trimethylbicyclo[4.1.0]hept-3-ene 136.1252005 2.1434 2.56 4.181 0 0 0 0 2 10 0
NPC269023 C13H10O2 Capillarin 198.07 1.4835 2.67 3.992 2 0 26.3 1 2 15 0
NPC26906 C10H18O 2-(4-Methylcyclohex-3-En-1-Yl)Propan-2-Ol 154.14 1.1223 2.45 2.369 1 1 20.23 5 1 11 0
NPC26960 C20H40O Trans-Phytol 296.31 1.7816 3.55 8.949 1 1 20.23 19 0 21 2
NPC271440 C12H10O 2-Phenylphenol 170.07 -0.4603 2.67 5.063 0 1 20.23 2 2 13 1
NPC27184 C10H18O 2-[(1R)-4-methylcyclohex-3-en-1-yl]propan-2-ol 154.1357652 1.1223 2.45 2.369 1 1 20.23 1 1 11 0
NPC273770 C17H20O9 methyl (3R,5R)-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,3,5-trihydroxycyclohexane-1-carboxylate 368.1107322 -1.9452 2.34 -0.555 7 5 153.75 6 2 26 0
NPC274681 C15H24O (4E,8Z)-4,7,7,11-tetramethyl-12-oxabicyclo[9.1.0]dodeca-4,8-diene 220.1827154 2.4043 3 4.314 1 0 12.53 0 2 16 0
NPC275462 C6H14O 1-Hexanol 102.1 -1.5494 2.01 1.989 1 1 20.23 6 0 7 0
NPC275463 C21H20O12 4-[5,7-dihydroxy-4-oxo-3-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-yl]-2-hydroxyphenolate 463.087651 -5.2259 2.45 -0.354 7 7 209.43 4 4 33 1
NPC277736 C15H24 (4aS,7R,7aR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene 204.1878008 2.1549 3.11 6.544 0 0 0 0 3 15 1
NPC277907 C15H26O (3S,6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol 222.1983655 3.7014 3 4.29 1 1 20.23 7 0 16 0
NPC278068 C16H18O9 354.0950822 -2.1962 2.23 -0.447 7 6 164.75 11 2 25 1
NPC278683 C23H48 tricosane 324.3756015 -5.9454 3.99 13.427 0 0 0 20 0 23 2
NPC278700 C15H24O (1S,4E,8E,11R)-4,7,7,11-tetramethyl-12-oxabicyclo[9.1.0]dodeca-4,8-diene 220.1827154 2.4043 3 4.314 1 0 12.53 0 2 16 0
NPC279026 C10H20O2 Decanoic Acid 172.15 -2.1697 2.34 4.156 2 1 37.3 10 0 12 0
NPC279418 C19H24O4 (E)-3-[4-hydroxy-3-[(Z)-4-hydroxy-3-methylbut-2-enyl]-5-(3-methylbut-2-enyl)phenyl]prop-2-enoic acid 316.1674592 2.3251 3.11 2.945 3 3 77.76 7 1 23 0
NPC27974 C8H10O 122.0731649 -0.1534 2.23 2.936 0 1 20.23 3 1 9 0
NPC281131 C21H20O12 Hyperoside 464.1 -4.8921 2.45 -0.354 7 8 206.6 12 4 33 1
NPC282305 C10H18O (1R,4S)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-4-ol 154.1357652 0.5023 2.45 2.756 1 1 20.23 1 2 11 0
NPC282694 C15H26O 222.1983655 1.3641 3 4.476 1 1 20.23 6 2 16 0
NPC28337 C13H12O3 Euparin 216.08 0.2856 2.56 2.112 1 1 50.44 5 2 16 0
NPC283655 C10H18O 154.1357652 0.9432 2.45 2.734 1 1 20.23 4 2 11 0
NPC283790 C16H20O9 6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydrochromen-2-one 356.1107322 -2.2529 2.23 -0.275 6 4 134.91 4 3 25 0
NPC284731 C10H18O (1R,4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol 154.1357652 0.9432 2.45 2.734 1 1 20.23 0 2 11 0
NPC286774 C15H24 204.1878008 1.7635 3.11 6.499 0 0 0 1 1 15 1
NPC286904 C7H8O 108.0575149 0.1817 2.12 2.156 0 1 20.23 2 1 8 0
NPC287331 C10H18O Eucalyptol 154.14 1.3109 2.45 2.595 1 0 9.23 3 0 11 0
NPC287462 C17H14O8 2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6,7-dimethoxychromen-4-one 346.0688674 -2.4445 2.45 1.456 2 4 125.68 3 3 25 0
NPC287660 C10H16 (1R,5R)-4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane 136.1252005 1.0301 2.56 4.222 0 0 0 1 2 10 0
NPC287731 C15H24 (1aR,4R,7bS)-1,1,4,7-tetramethyl-1a,2,3,4,5,6,7,7b-octahydrocyclopropa[e]azulene 204.1878008 2.051 3.11 5.835 0 0 0 0 3 15 1
NPC288932 C15H24 (6E)-7,11-dimethyl-3-methylidenedodeca-1,6,10-triene 204.1878008 4.3258 3.11 5.992 0 0 0 7 0 15 1
NPC288991 C10H16 136.1252005 3.3777 2.56 4.152 0 0 0 6 0 10 0
NPC289120 C15H26O (1aR,4R,4aR,7aS,7bS)-1,1,4,7-tetramethyl-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulen-4-ol 222.1983655 1.2587 3 5.078 1 1 20.23 0 3 16 1
NPC289366 C15H26O 1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol 222.1983655 1.3641 3 4.476 1 1 20.23 1 2 16 0
NPC289388 C12H22O2 Citronellyl Acetate 198.16 1.8432 2.56 4.026 2 0 26.3 11 0 14 0
NPC29 C29H50O (3S)-17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol 414.3861662 1.3 4.54 11.595 1 1 20.23 6 4 30 1
NPC290078 C15H24 (1S,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene 204.1878008 2.2115 3.11 5.46 0 0 0 1 2 15 1
NPC290189 C15H24 (1Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene 204.1878008 2.7967 3.11 6.294 0 0 0 1 1 15 1
NPC290319 C18H32O2 (9E,12Z)-octadeca-9,12-dienoic acid 280.2402303 -0.9485 3.22 7.865 2 1 37.3 14 0 20 2
NPC290613 C29H50O 17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol 414.3861662 1.3 4.54 11.595 1 1 20.23 6 4 30 1
NPC290905 C10H16O (3R)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-ol 152.1201151 0.7964 2.45 2.192 1 1 20.23 0 1 11 0
NPC291393 C15H24O 2-[(2R,4aR)-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl]prop-2-en-1-ol 220.1827154 1.2239 3 3.519 1 1 20.23 2 2 16 0
NPC291703 C12H12O (2E,4E)-1-phenylhexa-2,4-dien-1-one 172.088815 1.0046 2.67 4.438 1 0 17.07 3 1 13 0
NPC292092 C15H26O (1S,4R,4aS,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol 222.1983655 1.3641 3 4.476 1 1 20.23 1 2 16 0
NPC292792 C11H14O2 Methyleugenol 178.1 0.9251 2.45 3.003 0 0 18.46 6 1 13 0
NPC292841 C17H22O (3R,9Z)-heptadeca-1,9,16-trien-4,6-diyn-3-ol 242.1670653 2.5213 3.22 5.831 1 1 20.23 8 0 18 1
NPC294136 C15H24 (1R,9S)-11,11-dimethyl-4,8-dimethylidenebicyclo[7.2.0]undecane 204.1878008 2.3454 3.11 6.089 0 0 0 0 2 15 1
NPC294470 C14H18O7 298.1052529 -2.4611 2.23 0.227 6 4 116.45 9 2 21 0
NPC294548 C18H30O2 Linolenic Acid 278.22 -0.0979 3.22 7.538 2 1 37.3 15 0 20 2
NPC294902 C9H8O4 Caffeic Acid 180.04 -0.7993 2.01 1.141 2 3 77.76 5 1 13 0
NPC295010 C17H30 (3R,6aS)-5-[(Z)-but-2-en-2-yl]-3,3a,6,6,6a-pentamethyl-2,3,4,5-tetrahydro-1H-pentalene 234.234751 3.454 3.33 8.217 0 0 0 1 2 17 1
NPC295492 C17H20O9 Chlorogenic Acid Methyl Ester 368.11 -1.9452 2.34 -0.126 7 5 153.75 12 2 26 0
NPC296266 C18H36O (6R,10R)-6,10,14-trimethylpentadecan-2-one 268.2766158 1.0346 3.33 8.221 1 0 17.07 12 0 19 2
NPC296337 C10H16 136.1252005 2.1434 2.56 4.181 0 0 0 3 2 10 0
NPC296881 C10H16O 4,6,6-trimethylbicyclo[3.1.1]hept-3-en-7-ol 152.1201151 0.9431 2.45 1.881 1 1 20.23 0 1 11 0
NPC297422 C15H26O (1aS,4S,4aS,7S,7aR,7bR)-1,1,4,7-tetramethyl-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulen-4-ol 222.1983655 1.2587 3 5.078 1 1 20.23 0 3 16 1
NPC297517 C25H24O12 516.1267762 -2.3865 2.89 1.085 12 7 211.28 16 3 37 1
NPC297527 C15H24 204.1878008 1.7635 3.11 6.499 0 0 0 1 1 15 1
NPC297844 C15H24 204.1878008 1.7635 3.11 6.499 0 0 0 1 1 15 1
NPC298327 C15H26O (1R,4R,4aS,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol 222.1983655 1.3641 3 4.476 1 1 20.23 1 2 16 0
NPC29988 C10H16O (1S,3S,6R)-6-methyl-3-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptane 152.1201151 1.5647 2.45 2.292 1 0 12.53 1 2 11 0
NPC300649 C15H24 (1E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene 204.1878008 2.7967 3.11 6.294 0 0 0 1 1 15 1
NPC301195 C10H16O 3-methyl-6-propan-2-ylcyclohex-2-en-1-one 152.1201151 1.2899 2.45 2.238 1 0 17.07 1 1 11 0
NPC301344 C8H8O3 2-methoxybenzoate 151.0395191 -0.9694 2.01 1.873 2 0 49.36 2 1 11 0
NPC301585 C14H28O2 Myristic Acid 228.21 -3.3217 2.78 6.432 2 1 37.3 14 0 16 2
NPC302208 C17H22O4 (1,5,8-trimethyl-2-oxo-4,5,5a,6,7,9a-hexahydro-3aH-benzo[e][1]benzofuran-7-yl) acetate 290.1518092 1.5673 2.89 2.032 4 0 52.6 2 3 21 0
NPC302857 C16H18O9 Chlorogenic Acid 354.1 -2.1962 2.23 -0.447 7 6 164.75 11 2 25 1
NPC302890 C19H24O4 (E)-3-[4-hydroxy-3-[(E)-4-hydroxy-3-methylbut-2-enyl]-5-(3-methylbut-2-enyl)phenyl]prop-2-enoic acid 316.1674592 2.3251 3.11 2.945 3 3 77.76 7 1 23 0
NPC303683 C17H20O9 368.1107322 -1.9452 2.34 -0.126 7 5 153.75 12 2 26 0
NPC30430 C15H26O (1S,4R,4aR,8aR)-4,7-dimethyl-1-propan-2-yl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-4a-ol 222.1983655 1.3641 3 4.054 1 1 20.23 1 2 16 0
NPC305327 C15H24 (1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene 204.1878008 2.2008 3.11 5.901 0 0 0 1 2 15 1
NPC306990 C20H40O (Z,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-ol 296.3079159 1.7816 3.55 8.949 1 1 20.23 13 0 21 2
NPC307011 C15H24 204.1878008 1.7635 3.11 6.499 0 0 0 1 1 15 1
NPC308218 C10H18O (3S)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol 154.1357652 0.9432 2.45 2.734 1 1 20.23 0 2 11 0
NPC308809 C26H28O15 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[(2S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-[(2R,4R,5S)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one 580.1428202 -6.3055 2.67 -2.874 10 11 267.29 4 5 41 1
NPC309182 C15H24 (1S,4E,9R)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene 204.1878008 3.2289 3.11 6.044 0 0 0 0 2 15 1
NPC309355 C25H24O12 (1R,3S,4S,5S)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid 516.1267762 -2.3865 2.89 1.085 8 7 211.28 9 3 37 1
NPC310478 C15H26O 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-ol 222.1983655 0.6981 3 4.83 1 1 20.23 1 2 16 0
NPC310820 C6H10O (Z)-hex-2-enal 98.07316494 0.1876 2.01 1.85 1 0 17.07 3 0 7 0
NPC311211 C6H6O3 4-(hydroxymethyl)furan-2-carbaldehyde 126.0316941 -0.7952 1.79 0.037 2 1 50.44 2 1 9 0
NPC311988 C5H4O3 furan-2-carboxylate 111.008219 -1.0717 1.68 0.162 2 0 53.27 1 1 8 0
NPC312132 C10H14O Carvacrol 150.1 0.7546 2.45 3.556 0 1 20.23 5 1 11 0
NPC31371 C15H24 (1R,4Z,8Z,10S)-4,8,11,11-tetramethylbicyclo[8.1.0]undeca-4,8-diene 204.1878008 3.2134 3.11 5.999 0 0 0 0 2 15 1
NPC3155 C12H20O2 [(1R,3S,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] acetate 196.1463299 1.3223 2.56 3.474 2 0 26.3 2 2 14 0
NPC31789 C10H16O 2-(2,2,3-trimethylcyclopent-3-en-1-yl)acetaldehyde 152.1201151 1.4271 2.45 2.924 1 0 17.07 2 1 11 0
NPC32222 C15H26O 222.1983655 1.3573 3 5.176 1 1 20.23 5 3 16 1
NPC33967 C16H30O2 11-cyclopentylundecanoic acid 254.2245802 -2.6243 3 7.169 2 1 37.3 11 1 18 2
NPC34440 C15H26O 4,7-dimethyl-1-propan-2-yl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-4a-ol 222.1983655 1.3641 3 4.054 1 1 20.23 1 2 16 0
NPC34764 C10H16 1-Methyl-4-Prop-1-En-2-Ylcyclohexene 136.13 2.1424 2.56 3.729 0 0 0 3 1 10 0
NPC36408 C15H24 (1R,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane 204.1878008 3.2309 3.11 6.071 0 0 0 3 1 15 1
NPC3649 C10H16 136.1252005 2.7208 2.56 3.326 0 0 0 3 1 10 0
NPC38497 C8H14O 126.1044651 1.5927 2.23 1.796 1 0 17.07 6 0 9 0
NPC38751 C20H40O (Z)-3,7,11,15-tetramethylhexadec-2-en-1-ol 296.3079159 1.7816 3.55 8.949 1 1 20.23 13 0 21 2
NPC39068 C15H26O 222.1983655 2.2108 3 4.711 1 1 20.23 8 1 16 0
NPC39222 C15H26O (2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol 222.1983655 3.5719 3 4.346 1 1 20.23 7 0 16 0
NPC39927 C6H7O6P (5-formylfuran-3-yl)methyl phosphate 203.9823745 -2.0866 1.35 -1.192 5 0 112.44 4 1 13 0
NPC39977 C5H12O 88.088815 -0.9841 1.9 1.1 1 1 20.23 5 0 6 0
NPC40249 C10H16O 152.1201151 0.9693 2.45 2.127 1 0 17.07 3 2 11 0
NPC4079 C10H16O 152.1201151 1.583 2.45 2.126 1 0 17.07 3 1 11 0
NPC41348 C15H24 (3R,4aR,5S)-4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1H-naphthalene 204.1878008 2.676 3.11 5.846 0 0 0 1 2 15 1
NPC41385 C15H24 (1aS,4aR,7S,7aS,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene 204.1878008 2.1549 3.11 6.544 0 0 0 0 3 15 1
NPC41865 C10H16O 2-methyl-5-prop-1-en-2-ylcyclohexan-1-one 152.1201151 1.4248 2.45 1.982 1 0 17.07 1 1 11 0
NPC42538 C10H18O [(1S,4R,5S)-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]methanol 154.1357652 0.3926 2.45 3.167 1 1 20.23 1 1 11 0
NPC43114 C15H24 (1Z,6Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene 204.1878008 2.7967 3.11 6.294 0 0 0 1 1 15 1
NPC43728 C15H26O (3R,6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol 222.1983655 3.7014 3 4.29 1 1 20.23 7 0 16 0
NPC43822 C10H16O (6S)-3-methyl-6-propan-2-ylcyclohex-2-en-1-one 152.1201151 1.2899 2.45 2.238 1 0 17.07 1 1 11 0
NPC44671 C10H16O (1S,4S)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one 152.1201151 0.5558 2.45 2.434 1 0 17.07 1 2 11 0
NPC44751 C10H16O (4S)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one 152.1201151 0.9693 2.45 2.127 1 0 17.07 0 2 11 0
NPC45107 C15H24O 220.1827154 1.2589 3 4.855 1 0 12.53 0 4 16 0
NPC45540 C10H18 (1S,4R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexane 138.1408506 0.9414 2.56 5.143 0 0 0 1 2 10 1
NPC45727 C10H16 136.1252005 1.7112 2.56 4.427 0 0 0 4 1 10 0
NPC46248 C8H16O 128.1201151 -0.9039 2.23 2.707 1 1 20.23 7 0 9 0
NPC46405 C8H14O 2-hex-5-enyloxirane 126.1044651 -0.0938 2.23 2.538 1 0 12.53 5 1 9 0
NPC46587 C10H16O 6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-ol 152.1201151 0.7964 2.45 2.192 1 1 20.23 0 1 11 0
NPC47226 C8H8O2 2-phenylacetate 135.0446045 -0.8828 2.12 2.599 2 0 40.13 2 1 10 0
NPC47781 C18H16O7 Cirsileneol 344.09 -1.5796 2.67 1.198 1 2 94.45 9 3 25 0
NPC47946 C12H20O2 Geranyl Acetate 196.15 2.7188 2.56 3.264 2 0 26.3 10 0 14 0
NPC48739 C10H16O (1R,4S,5S)-4,6,6-trimethylbicyclo[3.1.1]heptan-3-one 152.1201151 0.702 2.45 2.434 1 0 17.07 0 1 11 0
NPC50450 C10H14O 6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-one 150.1044651 0.8225 2.45 2.249 1 0 17.07 0 1 11 0
NPC5048 C8H14O2 propan-2-yl (E)-2-methylbut-2-enoate 142.0993797 1.3148 2.12 2.121 2 0 26.3 3 0 10 0
NPC51189 C15H24 (1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene 204.1878008 2.7967 3.11 6.294 0 0 0 1 1 15 1
NPC51672 C8H14O2 propan-2-yl (Z)-2-methylbut-2-enoate 142.0993797 1.3148 2.12 2.121 2 0 26.3 3 0 10 0
NPC51758 C15H26O Nerolidol 222.2 3.7014 3 4.29 1 1 20.23 12 0 16 0
NPC52230 C15H24O (7S)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol 220.1827154 1.7158 3 4.157 1 1 20.23 0 3 16 0
NPC52955 C18H30O2 (9E,12E,15E)-octadeca-9,12,15-trienoic acid 278.2245802 -0.0979 3.22 7.538 2 1 37.3 13 0 20 2
NPC52961 C21H34O10 (2R,3S,4S,5R,6S)-2-[(Z)-(6,6-dimethyl-4-bicyclo[3.1.1]heptanylidene)-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]-6-methoxyoxane-3,4,5-triol 446.2151973 -2.6697 2.67 0.415 10 6 158.3 4 3 31 1
NPC5326 C18H32O2 (9Z,12E)-octadeca-9,12-dienoic acid 280.2402303 -0.9485 3.22 7.865 2 1 37.3 14 0 20 2
NPC53720 C15H26O 2-[(2S,4aS)-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]propan-2-ol 222.1983655 0.6981 3 4.83 1 1 20.23 1 2 16 0
NPC54235 C12H18O2 (6,6-dimethyl-4-methylidene-3-bicyclo[3.1.1]heptanyl) acetate 194.1306798 1.1755 2.56 2.932 2 0 26.3 2 1 14 0
NPC54264 C10H16O (4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one 152.1201151 0.9693 2.45 2.127 1 0 17.07 0 2 11 0
NPC55412 C20H30O Retinol 286.23 3.7849 3.55 6.158 1 1 20.23 11 1 21 1
NPC56505 C8H18O (3R)-octan-3-ol 130.1357652 -1.8481 2.23 2.807 1 1 20.23 5 0 9 0
NPC56857 C10H18O (6,6-dimethyl-4-bicyclo[3.1.1]heptanyl)methanol 154.1357652 0.3926 2.45 3.167 1 1 20.23 1 1 11 0
NPC57234 C10H16O (1R,4S,5S)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one 152.1201151 0.5558 2.45 2.434 1 0 17.07 1 2 11 0
NPC57877 C15H26O (1S,4R)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol 222.1983655 1.3641 3 4.476 1 1 20.23 1 2 16 0
NPC58779 C10H14O 2-methyl-6-methylideneocta-1,7-dien-3-one 150.1044651 2.2067 2.45 2.242 1 0 17.07 5 0 11 0
NPC58970 C10H14O 150.1044651 1.5954 2.45 1.756 1 0 17.07 3 1 11 0
NPC60288 C15H24 204.1878008 4.4725 3.11 6.136 0 0 0 10 0 15 1
NPC60556 C15H24 204.1878008 3.2289 3.11 6.044 0 0 0 3 2 15 1
NPC61769 C15H24 204.1878008 1.6446 3.11 6.499 0 0 0 1 3 15 1
NPC63264 C17H20O (9Z)-heptadeca-1,9,16-trien-4,6-diyn-3-one 240.1514153 2.6615 3.22 6.291 1 0 17.07 8 0 18 1
NPC64176 C10H16 136.1252005 3.2403 2.56 4.314 0 0 0 6 0 10 0
NPC66577 C15H24 204.1878008 4.1708 3.11 5.94 0 0 0 4 1 15 1
NPC66704 C13H16O5 1-(2,4,6-trimethoxyphenyl)butane-1,3-dione 252.0997736 -0.6383 2.34 1.012 2 0 61.83 6 1 18 0
NPC67761 C15H26O 222.1983655 3.7014 3 4.29 1 1 20.23 12 0 16 0
NPC67986 C12H20O2 [(3R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] acetate 196.1463299 1.3223 2.56 3.474 2 0 26.3 2 2 14 0
NPC68811 C20H27NO4 345.1940083 -0.4072 3.11 0.895 3 1 51.16 3 4 25 0
NPC68889 C10H18O Linalool (+) 154.14 2.4692 2.45 2.468 1 1 20.23 8 0 11 0
NPC69413 C18H30O (9Z,12E,15Z)-octadeca-9,12,15-trienal 262.2296656 -0.0505 3.33 7.952 1 0 17.07 13 0 19 2
NPC6984 C8H8O2 4-Hydroxyacetophenone 136.05 -0.7142 2.12 1.335 1 1 37.3 3 1 10 0
NPC70066 C17H14O7 5-hydroxy-2-(4-hydroxyphenoxy)-6,7-dimethoxychromen-4-one 330.0739528 -1.2258 2.56 2.032 1 2 94.45 4 3 24 0
NPC7084 C15H24O 220.1827154 1.2355 3 4.516 1 1 20.23 0 3 16 0
NPC71506 C10H18O 154.1357652 1.1223 2.45 1.947 1 1 20.23 5 1 11 0
NPC71613 C10H14O (1S,5R)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-7-one 150.1044651 1.3376 2.45 1.578 1 0 17.07 0 1 11 0
NPC71703 C10H16 (1S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-ene 136.1252005 1.5162 2.56 4.177 0 0 0 0 1 10 0
NPC74384 C11H8 penta-1,3-diynylbenzene 140.0626003 1.8228 2.67 5.444 0 0 0 0 1 11 1
NPC7491 C15H24O 220.18 1.9144 3 4.607 1 0 12.53 3 3 16 0
NPC75121 C10H16O (1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ol 152.1201151 1.5693 2.45 1.699 1 1 20.23 1 1 11 0
NPC75158 C10H18O (1R,3S)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol 154.1357652 0.9432 2.45 2.734 1 1 20.23 0 2 11 0
NPC75204 C6H10O 98.07316494 0.1876 2.01 1.85 1 0 17.07 4 0 7 0
NPC7522 C16H12O6 5,7-dihydroxy-2-(4-methoxyphenoxy)chromen-4-one 300.0633881 -1.174 2.56 2.476 1 2 85.22 3 3 22 0
NPC75584 C15H26O (1aR,4S,4aS,7R,7aS,7bS)-1,1,4,7-tetramethyl-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulen-4-ol 222.1983655 1.2587 3 5.078 1 1 20.23 0 3 16 1
NPC76145 C10H16 Limonene 136.13 2.1424 2.56 3.729 0 0 0 3 1 10 0
NPC76336 C10H8O4 Scopoletin 192.04 -0.2421 2.12 1.088 1 1 55.76 3 2 14 0
NPC76817 C15H24 1,1,4,7-tetramethyl-1a,2,3,4,4a,5,6,7b-octahydrocyclopropa[e]azulene 204.1878008 2.5253 3.11 5.944 0 0 0 0 3 15 1
NPC78500 C7H6O Benzaldehyde 106.04 -0.1924 2.12 3.08 1 0 17.07 1 1 8 0
NPC78551 C10H16 136.1252005 1.3695 2.56 4.222 0 0 0 2 1 10 0
NPC79576 C15H26O 222.1983655 1.3641 3 4.476 1 1 20.23 6 2 16 0
NPC79868 C10H18 5,7-dimethylocta-1,6-diene 138.1408506 2.9083 2.56 4.681 0 0 0 4 0 10 0
NPC79908 C19H26O11 Asterbatanoside A 430.15 -3.6973 2.34 -1.067 10 6 175.37 13 3 30 1
NPC8120 C10H14O 4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-3-en-2-one 150.1044651 0.9371 2.45 1.465 1 0 17.07 1 2 11 0
NPC82295 C8H7N Indole 117.06 -0.4204 2.23 2.45 1 1 15.79 0 2 9 0
NPC8235 C8H10 P-Xylene 106.08 1.284 2.34 4.708 0 0 0 2 1 8 0
NPC82533 C17H19NO4 Crinamine 301.13 -1.1196 2.78 0.478 3 1 51.16 3 5 22 0
NPC85665 C10H16O 2,2,4-trimethyl-3-oxabicyclo[2.2.2]oct-5-ene 152.1201151 1.2675 2.45 2.034 1 0 9.23 0 0 11 0
NPC85813 C18H32O2 Linoleic Acid 280.24 -0.9485 3.22 7.865 2 1 37.3 16 0 20 2
NPC86538 C15H24 Bicyclogermacrene 204.19 3.2134 3.11 5.999 0 0 0 4 2 15 1
NPC87099 C12H12 1,3-Dimethylnaphthalene 156.09 1.284 2.78 6.584 0 0 0 2 2 12 1
NPC87828 C12H20O2 196.1463299 1.3223 2.56 3.474 2 0 26.3 6 2 14 0
NPC88566 C10H14 134.1095504 1.2149 2.56 5.785 0 0 0 4 1 10 1
NPC88789 C21H20O12 464.0954761 -4.8921 2.45 -0.354 12 8 206.6 12 4 33 1
NPC89069 C10H18O 154.1357652 0.9432 2.45 2.734 1 1 20.23 4 2 11 0
NPC90506 C15H24 204.1878008 2.1549 3.11 6.544 0 0 0 3 3 15 1
NPC90566 C24H50 tetracosane 338.3912516 -6.2334 4.1 13.996 0 0 0 21 0 24 2
NPC90803 C15H24 Alloaromadendrene 204.19 2.1549 3.11 6.544 0 0 0 3 3 15 1
NPC91574 C15H24 (1R,8aR)-4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene 204.1878008 2.2115 3.11 5.46 0 0 0 1 2 15 1
NPC92774 C16H18O9 (3R,5R)-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,3,5-trihydroxycyclohexane-1-carboxylic acid 354.0950822 -2.1962 2.23 -0.876 7 6 164.75 5 2 25 1
NPC93559 C15H26O 222.1983655 1.0912 3 5.026 1 1 20.23 0 3 16 1
NPC95675 C15H24 204.1878008 1.7635 3.11 6.499 0 0 0 1 1 15 1
NPC95969 C15H26O 222.1983655 1.2587 3 5.078 1 1 20.23 5 3 16 1
NPC96294 C16H18O9 Scopolin 354.1 -1.989 2.23 -0.02 6 4 134.91 9 3 25 0
NPC96630 C10H18O (1S,4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol 154.1357652 0.9432 2.45 2.734 1 1 20.23 0 2 11 0
NPC97192 C10H16O (2S,5R)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one 152.1201151 1.4248 2.45 1.982 1 0 17.07 1 1 11 0
NPC98434 C15H22 1-methyl-4-[(E)-6-methylhept-4-en-2-yl]benzene 202.1721507 1.8785 3.11 8.049 0 0 0 4 1 15 1
NPC9880 C12H20O2 196.1463299 1.3223 2.56 3.474 2 0 26.3 6 2 14 0
NPC99480 C15H24O 220.1827154 1.7158 3 4.157 1 1 20.23 4 3 16 0

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