10 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: NPC98270
Formula: C33H52O4

Ingredient ID: NPC94830
Formula: C19H26O12

Ingredient ID: NPC43300
Formula: C30H48O

Ingredient ID: NPC27657
Formula: C29H50O

Ingredient ID: NPC27207
Formula: C15H24O

Ingredient ID: NPC23704
Formula: C19H26O12

Ingredient ID: NPC201459
Formula: C30H48O2

Ingredient ID: NPC192638
Formula: C30H50O

Ingredient ID: NPC143783
Formula: C15H24O

Ingredient ID: NPC128825
Formula: C8H8O3

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC128825 C8H8O3 Methyl Salicylate 152.05 -0.4491 2.01 2.585 2 1 46.53 4 1 11 0
NPC143783 C15H24O 220.1827154 2.1382 3 4.163 1 1 20.23 1 2 16 0
NPC192638 C30H50O Lupeol 426.39 3.2313 4.65 11.901 1 1 20.23 9 5 31 1
NPC201459 C30H48O2 Betulone 440.37 2.7103 4.54 9.107 2 1 37.3 9 5 32 1
NPC23704 C19H26O12 446.1424263 -3.4322 2.23 -0.246 12 6 184.6 7 3 31 2
NPC27207 C15H24O 220.1827154 2.1382 3 4.163 1 1 20.23 1 2 16 0
NPC27657 C29H50O 414.3861662 1.3 4.54 11.595 1 1 20.23 6 4 30 1
NPC43300 C30H48O Lupenone 424.37 3.801 4.65 11.294 1 0 17.07 8 5 31 1
NPC94830 C19H26O12 446.1424263 -3.4322 2.23 -0.246 12 6 184.6 7 3 31 2
NPC98270 C33H52O4 Methyl 3Beta-Acetoxylup-20(29)-En-28-Oate 512.39 2.9796 4.65 10.468 4 0 52.6 13 5 37 1

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