9 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: NPC88566
Formula: C10H14

Ingredient ID: NPC284877
Formula: C18H18N2O2

Ingredient ID: NPC271681
Formula: C13H12O4

Ingredient ID: NPC270768
Formula: C30H48O4

Ingredient ID: NPC244954
Formula: C28H42O5

Ingredient ID: NPC202828
Formula: C64H104O30

Ingredient ID: NPC166788
Formula: C10H12O2

Ingredient ID: NPC149087
Formula: C12H14N2O

Ingredient ID: NPC113733
Formula: C29H48O

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC113733 C29H48O Stigmasterol 412.37 1.2566 4.54 11.071 1 1 20.23 12 4 30 1
NPC149087 C12H14N2O 202.1106131 -0.2105 2.45 0.823 3 0 23.55 0 3 15 0
NPC166788 C10H12O2 Thymoquinone 164.08 1.0183 2.34 1.102 2 0 34.14 4 1 12 0
NPC202828 C64H104O30 Sieboldianoside A 1352.66 -7.5784 5.2 0.392 30 17 471.74 41 11 94 3
NPC244954 C28H42O5 458.3032244 2.5629 3.99 4.302 3 3 86.99 13 1 33 1
NPC270768 C30H48O4 Hederagenin 472.36 1.0391 4.32 8.349 4 3 77.76 11 5 34 1
NPC271681 C13H12O4 Salfredin B11 232.07 0.368 2.45 1.861 2 1 55.76 3 3 17 0
NPC284877 C18H18N2O2 294.1368278 -0.0609 3 1.578 4 1 43.78 0 4 22 0
NPC88566 C10H14 134.1095504 1.2149 2.56 5.785 0 0 0 4 1 10 1

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