39 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.



5 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC97503
Formula: C21H22O9

Ingredient ID: NPC95615
Formula: C30H50O2

Ingredient ID: NPC72016
Formula: C28H30O15

Ingredient ID: NPC64250
Formula: C6H11NO2

Ingredient ID: NPC60120
Formula: C12H18O3

Ingredient ID: NPC53078
Formula: C19H18O9

Ingredient ID: NPC48892
Formula: C39H32O14

Ingredient ID: NPC44382
Formula: C8H11NO2

Ingredient ID: NPC37407
Formula: C15H14O4

Ingredient ID: NPC32641
Formula: C33H40O19

Ingredient ID: NPC304272
Formula: C14H12O4

Ingredient ID: NPC300943
Formula: C18H16O8

Ingredient ID: NPC287472
Formula: C20H20O9

Ingredient ID: NPC280881
Formula: C20H20O9

Ingredient ID: NPC27657
Formula: C29H50O

Ingredient ID: NPC276377
Formula: C26H28O14

Ingredient ID: NPC270620
Formula: C18H16O7

Ingredient ID: NPC266852
Formula: C12H18O3

Ingredient ID: NPC261230
Formula: C41H74O6

Ingredient ID: NPC260265
Formula: C19H20O5

Ingredient ID: NPC258754
Formula: C16H14O4

Ingredient ID: NPC257757
Formula: C19H18O9

Ingredient ID: NPC256188
Formula: C33H40O19

Ingredient ID: NPC250891
Formula: C18H16O9

Ingredient ID: NPC249281
Formula: C27H30O14

Ingredient ID: NPC246943
Formula: C27H30O15

Ingredient ID: NPC230301
Formula: C29H50O

Ingredient ID: NPC224200
Formula: C21H18O5

Ingredient ID: NPC222696
Formula: C16H21NO6

Ingredient ID: NPC203922
Formula: C18H16O8

Ingredient ID: NPC200388
Formula: C18H16O8

Ingredient ID: NPC189277
Formula: C19H18O8

Ingredient ID: NPC155049
Formula: C10H18N4O7

Ingredient ID: NPC150164
Formula: C26H28O14

Ingredient ID: NPC146976
Formula: C20H19NO5

Ingredient ID: NPC116458
Formula: C27H30O15

Ingredient ID: NPC109736
Formula: C13H16O2

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC109736 C13H16O2 2,3-dimethyl-5-(3-methylbut-2-enyl)cyclohexa-2,5-diene-1,4-dione 204.1150298 2.8759 2.67 1.757 2 0 34.14 2 1 15 0
NPC116458 C27H30O15 594.1584703 -5.6787 2.78 -0.225 11 9 245.29 16 5 42 2
NPC146976 C20H19NO5 (6,7-Dimethoxyisoquinolin-1-Yl)-(3,4-Dimethoxyphenyl)Methanone 353.13 -0.471 3 2.659 2 0 66.88 10 3 26 0
NPC150164 C26H28O14 564.1479056 -5.3405 2.78 -0.025 10 8 225.06 15 5 40 1
NPC155049 C10H18N4O7 2,4-diamino-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydro-1H-pyrimidin-6-one 306.1175489 -3.668 1.35 -2.984 11 8 193.87 3 2 21 2
NPC189277 C19H18O8 2-(2,5-dihydroxy-4-methoxyphenyl)-3,5,7-trimethoxychromen-4-one 374.1001675 -1.9715 2.67 1.438 2 2 103.68 5 3 27 0
NPC200388 C18H16O8 360.0845175 -2.38 2.56 0.919 2 3 114.68 10 3 26 0
NPC203922 C18H16O8 2-(2,3-dihydroxy-4-methoxyphenyl)-5-hydroxy-3,7-dimethoxychromen-4-one 360.0845175 -2.38 2.56 1.348 2 3 114.68 4 3 26 0
NPC222696 C16H21NO6 8-(2,3-dihydroxy-3-methoxybutoxy)-4-methoxy-1-methylquinolin-2-one 323.1368874 -1.764 2.45 0.589 6 2 88.46 6 2 23 0
NPC224200 C21H18O5 350.1154237 -0.048 3.22 3.197 0 0 46.15 0 6 26 0
NPC230301 C29H50O Beta-Sitosterol 414.39 1.3 4.54 11.595 1 1 20.23 13 4 30 1
NPC246943 C27H30O15 594.1584703 -5.6787 2.78 -0.225 11 9 245.29 16 5 42 2
NPC249281 C27H30O14 578.1635556 -5.1787 2.89 0.478 10 8 225.06 15 5 41 1
NPC250891 C18H16O9 2-(2,3-dihydroxy-4-methoxyphenyl)-5,6-dihydroxy-3,7-dimethoxychromen-4-one 376.0794321 -2.8403 2.45 0.814 2 4 134.91 4 3 27 0
NPC256188 C33H40O19 740.2163791 -6.9256 3 -1.059 15 11 304.21 21 6 52 2
NPC257757 C19H18O9 2-(2,5-dihydroxy-4-methoxyphenyl)-5-hydroxy-3,6,7-trimethoxychromen-4-one 390.0950822 -2.4318 2.56 0.475 2 3 123.91 5 3 28 0
NPC258754 C16H14O4 3-methoxy-5-(6-methoxy-1-benzofuran-2-yl)phenol 270.0892089 -0.718 2.78 2.933 0 1 51.83 3 3 20 0
NPC260265 C19H20O5 328.1310737 1.9846 3 3.83 3 0 61.83 7 3 24 0
NPC261230 C41H74O6 [3-hexadecanoyloxy-2-[(2E,4E)-hexa-2,4-dienoyl]oxypropyl] hexadecanoate 662.5485401 -6.3479 5.31 17.15 6 0 78.9 38 0 47 2
NPC266852 C12H18O3 2-[(1R,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid 210.1255944 -0.3357 2.45 1.818 3 1 54.37 5 1 15 0
NPC270620 C18H16O7 Ayanin 344.09 -1.9197 2.67 1.882 2 2 94.45 9 3 25 0
NPC276377 C26H28O14 564.1479056 -5.168 2.78 0.018 10 8 225.06 14 5 40 1
NPC27657 C29H50O 414.3861662 1.3 4.54 11.595 1 1 20.23 6 4 30 1
NPC280881 C20H20O9 6-hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-3,5,7-trimethoxychromen-4-one 404.1107322 -2.0233 2.67 0.994 2 2 112.91 6 3 29 0
NPC287472 C20H20O9 2-(2,5-dihydroxy-4-methoxyphenyl)-3,5,6,7-tetramethoxychromen-4-one 404.1107322 -2.0233 2.67 0.994 2 2 112.91 6 3 29 0
NPC300943 C18H16O8 5,6,3'-Trihydroxy-3,7,4'-Trimethoxyflavone 360.08 -2.38 2.56 1.348 2 3 114.68 10 3 26 0
NPC304272 C14H12O4 (E)-3-[5-[(Z)-hept-4-en-2-ynoyl]furan-2-yl]prop-2-enoic acid 244.0735589 0.5249 2.56 3.497 3 1 67.51 4 1 18 0
NPC32641 C33H40O19 740.2163791 -6.9256 3 -1.059 15 11 304.21 21 6 52 2
NPC37407 C15H14O4 methyl (E)-3-[5-[(Z)-hept-4-en-2-ynoyl]furan-2-yl]prop-2-enoate 258.0892089 0.7759 2.67 3.818 3 0 56.51 5 1 19 0
NPC44382 C8H11NO2 4-(2-aminoethyl)-3,5,6-trideuteriobenzene-1,2-diol 153.0789786 -1.4033 2.01 0.57 1 3 66.48 2 1 11 0
NPC48892 C39H32O14 [(2S,3S,5S)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-5-hydroxy-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-6-methyloxan-4-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate 724.1792057 -3.3918 4.21 5.437 8 6 218.74 11 6 53 3
NPC53078 C19H18O9 5,6-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-3,7-dimethoxychromen-4-one 390.0950822 -2.4318 2.56 0.904 2 3 123.91 5 3 28 0
NPC60120 C12H18O3 Jasmonic Acid 210.13 -0.3357 2.45 1.818 3 1 54.37 7 1 15 0
NPC64250 C6H11NO2 129.0789786 -1.6697 1.79 0.173 3 2 49.33 2 1 9 0
NPC72016 C28H30O15 606.1584703 -4.9614 2.89 0.286 11 7 231.13 17 5 43 2
NPC95615 C30H50O2 (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol 442.3810808 2.1406 4.54 9.714 2 2 40.46 2 5 32 1
NPC97503 C21H22O9 418.1263823 -1.6148 2.78 1.513 2 1 101.91 7 3 30 0

Download Data

All data can be downloaded by:

   → Selecting data type in the below download table
   → Then click the download button.
Data Section
Select to Download
1. General Information & structure data (InChi, InChiKey, SMILES)  
2. Physico-chemical Properties