18 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.



11 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC82190
Formula: C25H26O9

Ingredient ID: NPC3449
Formula: C22H22O10

Ingredient ID: NPC283480
Formula: C27H28O10

Ingredient ID: NPC282923
Formula: C15H10O4

Ingredient ID: NPC209393
Formula: C22H22O9

Ingredient ID: NPC208651
Formula: C27H28O11

Ingredient ID: NPC206641
Formula: C27H28O11

Ingredient ID: NPC205172
Formula: C22H22O9

Ingredient ID: NPC192219
Formula: C25H26O9

Ingredient ID: NPC174599
Formula: C25H26O9

Ingredient ID: NPC148323
Formula: C27H28O10

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC148323 C27H28O10 Alvaradoin G 512.17 -0.5402 3.33 2.074 8 4 159.82 14 4 37 0
NPC174599 C25H26O9 Alvaradoin K 470.16 -0.9193 3.22 1.763 7 5 153.75 12 4 34 0
NPC192219 C25H26O9 Alvaradoin L 470.16 -0.9193 3.22 1.763 7 5 153.75 12 4 34 0
NPC205172 C22H22O9 Alvaradoin F 430.13 -2.3589 2.89 1.314 7 5 153.75 10 4 31 0
NPC206641 C27H28O11 Alvaradoin J 528.16 -1.1545 3.22 0.742 9 5 180.05 15 4 38 0
NPC208651 C27H28O11 Alvaradoin I 528.16 -1.1545 3.22 0.742 9 5 180.05 15 4 38 0
NPC209393 C22H22O9 Alvaradoin E 430.13 -2.3589 2.89 1.314 7 5 153.75 10 4 31 0
NPC282923 C15H10O4 Chrysophanol 254.06 -0.8062 2.67 1.627 2 2 74.6 3 3 19 0
NPC283480 C27H28O10 Alvaradoin H 512.17 -0.5402 3.33 2.074 8 4 159.82 14 4 37 0
NPC3449 C22H22O10 Alvaradoin N 446.12 -2.9732 2.78 -0.018 8 6 173.98 11 4 32 1
NPC82190 C25H26O9 Alvaradoin M 470.16 -0.9193 3.22 1.763 7 5 153.75 12 4 34 0

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