37 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.



7 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC9432
Formula: C28H20O10

Ingredient ID: NPC81010
Formula: C9H8O3

Ingredient ID: NPC70799
Formula: C25H24O9

Ingredient ID: NPC55830
Formula: C34H46O18

Ingredient ID: NPC54395
Formula: C48H74O19

Ingredient ID: NPC42251
Formula: C25H24O9

Ingredient ID: NPC39522
Formula: C28H36O13

Ingredient ID: NPC34864
Formula: C14H12O4

Ingredient ID: NPC311929
Formula: C22H34O5

Ingredient ID: NPC305648
Formula: C10H17N7O4

Ingredient ID: NPC29883
Formula: C7H6O3

Ingredient ID: NPC291516
Formula: C24H24O10

Ingredient ID: NPC282061
Formula: C20H34O3

Ingredient ID: NPC280717
Formula: C38H56O4

Ingredient ID: NPC264711
Formula: C30H48O3

Ingredient ID: NPC249045
Formula: C29H50O

Ingredient ID: NPC247871
Formula: C7H6O3

Ingredient ID: NPC209660
Formula: C9H8O3

Ingredient ID: NPC203410
Formula: C20H32O5

Ingredient ID: NPC198141
Formula: C28H22O10

Ingredient ID: NPC196776
Formula: C30H50

Ingredient ID: NPC19530
Formula: C30H44O5

Ingredient ID: NPC179793
Formula: C20H32O4

Ingredient ID: NPC179749
Formula: C20H32O4

Ingredient ID: NPC16830
Formula: C20H18O6

Ingredient ID: NPC163508
Formula: C28H22O7

Ingredient ID: NPC161571
Formula: C14H12O3

Ingredient ID: NPC158189
Formula: C20H32O4

Ingredient ID: NPC149886
Formula: C20H34O3

Ingredient ID: NPC145145
Formula: C27H22O9

Ingredient ID: NPC142753
Formula: C35H60O6

Ingredient ID: NPC137167
Formula: C28H48O

Ingredient ID: NPC130449
Formula: C28H36O13

Ingredient ID: NPC114392
Formula: C14H12O5

Ingredient ID: NPC113831
Formula: C25H24O8

Ingredient ID: NPC11069
Formula: C22H36O4

Ingredient ID: NPC103281
Formula: C20H16O6

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC103281 C20H16O6 (3Z,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzodioxol-5-ylmethylidene)oxolan-2-one 352.0946882 -0.3976 3 3.341 2 0 63.22 3 5 26 0
NPC11069 C22H36O4 364.2613596 1.0883 3.44 6.158 4 1 63.6 8 2 26 1
NPC113831 C25H24O8 (1R,3aS,4R,8bS)-1-(3,4-dihydroxyphenyl)-4-(4-hydroxy-3,5-dimethoxyphenyl)-3,3a,4,8b-tetrahydro-1H-indeno[1,2-c]furan-5,7-diol 452.1471177 -2.9399 3.33 1.573 1 5 128.84 4 5 33 0
NPC114392 C14H12O5 260.0684735 -1.8337 2.45 2.157 0 5 101.15 7 2 19 0
NPC130449 C28H36O13 580.2155912 -3.8727 3.11 -0.312 13 5 174.99 18 5 41 0
NPC137167 C28H48O (8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol 400.3705162 2.8089 4.43 12.391 1 1 20.23 5 4 29 1
NPC142753 C35H60O6 (3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S)-17-[(2R,5R)-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-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 576.4389896 -0.4469 4.65 10.487 6 4 99.38 9 5 41 1
NPC145145 C27H22O9 (1R,4aS,9aR)-3-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-6,8,9a-trihydroxy-1-(3,4,5-trihydroxyphenyl)-4,4a-dihydro-1H-fluoren-9-one 490.1263823 -3.3351 3.44 1.358 2 8 178.91 3 5 36 1
NPC149886 C20H34O3 322.2507949 0.7092 3.33 5.418 3 2 57.53 6 2 23 1
NPC158189 C20H32O4 336.2300595 0.4377 3.22 3.322 4 2 74.6 6 2 24 0
NPC161571 C14H12O3 Resveratrol 228.08 -0.9131 2.67 3.436 0 3 60.69 5 2 17 0
NPC163508 C28H22O7 Scirpusin A 470.14 -2.6294 3.77 4.83 0 6 130.61 10 5 35 1
NPC16830 C20H18O6 354.1103383 -1.6034 3 2.576 2 0 55.38 2 6 26 0
NPC179749 C20H32O4 336.2300595 0.9181 3.22 5.928 4 2 74.6 6 2 24 1
NPC179793 C20H32O4 336.2300595 1.2958 3.22 5.414 4 2 74.6 6 2 24 1
NPC19530 C30H44O5 484.3188745 2.4525 4.21 6.599 5 2 83.83 3 5 35 1
NPC196776 C30H50 (3R,8R,9R,10S,13R,14R,17R)-17-[(E,2R,5R)-5-ethyl-6-methylhept-3-en-2-yl]-3,10,13-trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene 410.3912516 2.7031 4.76 13.664 0 0 0 5 4 30 1
NPC198141 C28H22O10 5-[(2S,3S)-3-(3,5-dihydroxyphenyl)-4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-6,7-dihydroxy-2,3-dihydro-1-benzofuran-2-yl]benzene-1,2,3-triol 518.1212969 -4.0103 3.44 2.588 0 9 191.3 4 5 38 1
NPC203410 C20H32O5 352.2249741 0.576 3.11 3.64 5 3 94.83 6 2 25 0
NPC209660 C9H8O3 164.0473441 -0.7519 2.12 1.222 1 2 57.53 2 1 12 0
NPC247871 C7H6O3 Sesamol 138.03 -0.763 1.9 0.872 0 1 38.69 1 2 10 0
NPC249045 C29H50O (3S,8R,9R,10S,13R,14S,17R)-17-[(2R,5S)-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
NPC264711 C30H48O3 (10R)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid 456.3603454 1.4838 4.43 8.954 3 2 57.53 1 5 33 1
NPC280717 C38H56O4 576.4178603 2.1944 5.2 13.077 2 1 55.76 18 5 42 1
NPC282061 C20H34O3 322.2507949 0.3864 3.33 6.037 3 2 57.53 6 2 23 1
NPC291516 C24H24O10 (E)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxyphenyl]prop-2-enoic acid 472.136947 -1.8159 3 3.055 8 5 162.98 9 3 34 0
NPC29883 C7H6O3 Paraben 138.03 -0.7001 1.9 1.07 2 2 57.53 3 1 10 0
NPC305648 C10H17N7O4 [(3aS,4R,10aS)-2,6-diamino-10,10-dihydroxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-4-yl]methyl carbamate 299.134202 -1.716 1.35 0.898 11 9 180.8 3 3 21 2
NPC311929 C22H34O5 378.2406242 0.8168 3.33 4.062 5 1 80.67 8 2 27 0
NPC34864 C14H12O4 Piceatannol 244.07 -1.3734 2.56 2.691 0 4 80.92 6 2 18 0
NPC39522 C28H36O13 (2S,3R,4S,5S,6R)-3-[(3aR,6aR)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-[hydroxy(methoxy)methyl]-5-methoxy-6-phenoxyoxane-3,4,5-triol 580.2155912 -3.9162 3.11 1.017 9 5 174.99 9 5 41 0
NPC42251 C25H24O9 468.1420323 -2.3347 3.22 1.916 1 5 138.07 6 4 34 0
NPC54395 C48H74O19 Chiisanoside 954.48 -2.4457 4.65 2.493 19 10 301.05 27 8 67 3
NPC55830 C34H46O18 (2S,3R,4S,5S,6R)-2-[4-[(3R,3aS,6R,6aS)-6-[3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 742.2684146 -5.6196 3.22 -1.42 12 8 254.14 12 6 52 3
NPC70799 C25H24O9 5-[(1R,3aS,4R,8bS)-5,7-dihydroxy-4-(4-hydroxy-3,5-dimethoxyphenyl)-3,3a,4,8b-tetrahydro-1H-indeno[1,2-c]furan-1-yl]benzene-1,2,3-triol 468.1420323 -3.4002 3.22 1.039 1 6 149.07 4 5 34 1
NPC81010 C9H8O3 Coumaric Acid 164.05 -0.339 2.12 1.886 2 2 57.53 4 1 12 0
NPC9432 C28H20O10 516.1056468 -3.7865 3.44 1.038 3 8 195.98 4 5 38 1

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1. General Information & structure data (InChi, InChiKey, SMILES)  
2. Physico-chemical Properties