7 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: NPC48034
Formula: C21H20O9

Ingredient ID: NPC46274
Formula: C15H10O6

Ingredient ID: NPC20791
Formula: C15H10O7

Ingredient ID: NPC181592
Formula: C29H34O17

Ingredient ID: NPC169749
Formula: C15H10O8

Ingredient ID: NPC127624
Formula: C17H14O7

Ingredient ID: NPC116775
Formula: C15H10O6

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC116775 C15H10O6 Kaempferol 286.05 -2.3409 2.45 1.915 2 4 107.22 5 3 21 0
NPC127624 C17H14O7 Malvidin 332.09 -1.9448 2.56 0.388 1 5 99.38 9 3 24 0
NPC169749 C15H10O8 Myricetin 318.04 -3.2615 2.23 0.847 2 6 147.68 7 3 23 1
NPC181592 C29H34O17 656.1952497 -5.4386 2.78 -2.257 11 11 257.68 9 5 46 2
NPC20791 C15H10O7 Quercetin 302.04 -2.8012 2.34 1.381 2 5 127.45 6 3 22 0
NPC46274 C15H10O6 Cyanidin 288.06 -2.3015 2.45 0.742 1 6 101.15 6 3 21 1
NPC48034 C21H20O9 416.1107322 -3.4715 2.78 1.846 6 5 145.91 3 4 30 0

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