13 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: NPC41296
Formula: C123H80O78

Ingredient ID: NPC259364
Formula: C82H54O52

Ingredient ID: NPC245789
Formula: C24H22O14

Ingredient ID: NPC235279
Formula: C24H22O15

Ingredient ID: NPC235260
Formula: C21H18O13

Ingredient ID: NPC225710
Formula: C7H6O5

Ingredient ID: NPC215412
Formula: C24H22O14

Ingredient ID: NPC179950
Formula: C21H20O12

Ingredient ID: NPC178134
Formula: C14H6O8

Ingredient ID: NPC168579
Formula: C21H20O11

Ingredient ID: NPC133671
Formula: C21H20O11

Ingredient ID: NPC126029
Formula: C15H14O6

Ingredient ID: NPC11666
Formula: C21H18O12

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC11666 C21H18O12 (2S,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid 462.079826 -4.3296 2.45 0.337 8 7 203.44 4 4 33 1
NPC126029 C15H14O6 (-)-Epicatechin 290.08 -2.494 2.45 0.406 1 5 110.38 6 3 21 0
NPC133671 C21H20O11 Astragalin 448.1 -4.4318 2.56 0.18 7 7 186.37 11 4 32 1
NPC168579 C21H20O11 Kuromanin 450.12 -4.0484 2.56 -0.795 6 9 180.3 12 4 32 1
NPC178134 C14H6O8 Ellagic Acid 302.01 -2.0234 2.12 -0.046 2 4 133.52 4 4 22 0
NPC179950 C21H20O12 Isoquercetin 464.1 -4.8921 2.45 -0.354 7 8 206.6 12 4 33 1
NPC215412 C24H22O14 3-[[(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid 534.1009554 -4.2676 2.56 0.272 10 7 229.74 8 4 38 1
NPC225710 C7H6O5 Gallic Acid 170.02 -1.6207 1.68 0.002 2 4 97.99 5 1 12 0
NPC235260 C21H18O13 Quercetin Glucuronide 478.07 -4.7899 2.34 -0.197 8 8 223.67 12 4 34 1
NPC235279 C24H22O15 3-[[(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid 550.09587 -4.7279 2.45 -0.262 10 8 249.97 8 4 39 1
NPC245789 C24H22O14 3-[[(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid 536.1166054 -3.8842 2.56 -0.703 9 9 223.67 8 4 38 1
NPC259364 C82H54O52 1870.158112 -14.8376 4.76 -1.754 22 29 877.36 8 16 134 2
NPC41296 C123H80O78 2804.229343 -22.1033 6.41 -3.095 33 43 1310.54 13 24 201 3

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