TPCN05795

Name 21??-hydroxyfriedelane-1,3-dione
Molecular Formula C30H48O3
Molecular Weight 456.71
CAS Registry Number 1383564-51-9
SMILES CC1C(=O)CC(=O)C2C1(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 0.000350% Fitoterapia. 2011 Oct;82(7):1047-51. 10.1016/j.fitote.2011.06.007.
Properties
HBA 3 HBD 1
HeavyAtoms 33 AlogP 6.61
TPSA 54.37 RotatableBonds 0
FractionCSP3 0.93 Rings 5
AromaticRings 0 AliphaticRings 5