TPCN05817

Name 21??-hydroxy-D:A-friedo-olean-3-one
Molecular Formula C30H50O2
Molecular Weight 442.73
CAS Registry Number 59995-80-1
SMILES CC1C(=O)CCC2C1(C)CCC1C2(C)CCC2(C)C3CC(C)(C)C(O)CC3(C)CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Salacia verrucosa Stems 0.000192% Fitoterapia. 2011 Oct;82(7):1047-51. 10.1016/j.fitote.2011.06.007.
Properties
HBA 2 HBD 1
HeavyAtoms 32 AlogP 7.43
TPSA 37.30 RotatableBonds 0
FractionCSP3 0.97 Rings 5
AromaticRings 0 AliphaticRings 5