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: NPC9613
Formula: C30H48O6

Ingredient ID: NPC71074
Formula: C30H48O4

Ingredient ID: NPC51700
Formula: C30H48O3

Ingredient ID: NPC304110
Formula: C39H54O6

Ingredient ID: NPC188145
Formula: C30H46O6

Ingredient ID: NPC158059
Formula: C30H48O4

Ingredient ID: NPC114159
Formula: C30H48O5

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC114159 C30H48O5 Rotundic Acid 488.35 -0.046 4.21 6.075 5 4 97.99 12 5 35 1
NPC158059 C30H48O4 Pomolic Acid 472.36 1.0447 4.32 6.778 4 3 77.76 11 5 34 1
NPC188145 C30H46O6 502.3294392 -0.5617 4.1 5.511 6 5 118.22 2 6 36 1
NPC304110 C39H54O6 618.3920394 1.5311 5.09 10.419 5 3 104.06 15 6 45 1
NPC51700 C30H48O3 Ursolic Acid 456.36 1.4838 4.43 8.954 3 2 57.53 10 5 33 1
NPC71074 C30H48O4 Corosolic Acid 472.36 1.2611 4.32 8.142 4 3 77.76 11 5 34 1
NPC9613 C30H48O6 Myrianthic Acid 504.35 -0.2687 4.1 5.263 6 5 118.22 13 5 36 1

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