14 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: NPC98518
Formula: C21H22O12

Ingredient ID: NPC268342
Formula: C15H14O7

Ingredient ID: NPC25389
Formula: C20H22O12

Ingredient ID: NPC225710
Formula: C7H6O5

Ingredient ID: NPC219876
Formula: C15H14O6

Ingredient ID: NPC21019
Formula: C21H24O13

Ingredient ID: NPC208957
Formula: C13H16O10

Ingredient ID: NPC195912
Formula: C56H38O31

Ingredient ID: NPC180432
Formula: C25H32O13

Ingredient ID: NPC178857
Formula: C20H20O13

Ingredient ID: NPC122889
Formula: C56H38O31

Ingredient ID: NPC115739
Formula: C20H20O13

Ingredient ID: NPC108455
Formula: C13H16O10

Ingredient ID: NPC104222
Formula: C41H32O26

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC104222 C41H32O26 Pentagalloyl Glucose 940.12 -7.5719 3.11 0.697 11 15 444.18 31 6 67 3
NPC108455 C13H16O10 Beta-Glucogallin 332.07 -3.5251 1.79 -1.304 7 7 177.14 11 2 23 1
NPC115739 C20H20O13 468.0903907 -3.919 2.23 0.375 8 8 223.67 7 3 33 1
NPC122889 C56H38O31 1206.139704 -10.1749 4.21 -1.977 11 20 545.33 2 11 87 2
NPC178857 C20H20O13 468.0903907 -3.919 2.23 0.375 8 8 223.67 7 3 33 1
NPC180432 C25H32O13 540.1842911 -2.1488 2.78 0.485 6 3 160.83 12 3 38 1
NPC195912 C56H38O31 1206.139704 -10.1749 4.21 -1.977 11 20 545.33 2 11 87 2
NPC208957 C13H16O10 3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoic acid 332.0743467 -3.3676 1.79 -1.535 7 7 177.14 4 2 23 1
NPC21019 C21H24O13 [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-3,5-dimethoxyphenoxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate 484.1216908 -3.7828 2.34 -0.733 6 7 204.83 8 3 34 1
NPC219876 C15H14O6 Cianidanol 290.08 -2.494 2.45 0.406 1 5 110.38 6 3 21 0
NPC225710 C7H6O5 Gallic Acid 170.02 -1.6207 1.68 0.002 2 4 97.99 5 1 12 0
NPC25389 C20H22O12 454.1111261 -3.731 2.34 -0.289 12 7 195.6 15 3 32 1
NPC268342 C15H14O7 Gallocatechin 306.07 -2.9543 2.34 -0.128 1 6 130.61 7 3 22 1
NPC98518 C21H22O12 466.1111261 -4.6738 2.45 -1.509 7 8 206.6 4 4 33 1

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1. General Information & structure data (InChi, InChiKey, SMILES)  
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