TPCN05271

Name Dammaran-3-one, 20,24-epoxy-19,25-dihydroxy-, (20S,24S)- (9CI)
Molecular Formula C30H50O4
Molecular Weight 474.73
CAS Registry Number 225782-63-8
SMILES CC(C)(O)C1CCC(C)(C2CCC3(C)C2CCC2C4(CO)CCC(=O)C(C)(C)C4CCC23C)O1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Capparaceae Cleome gynandra Whole plants 0.014000% J Nat Prod. 1999. 62, 616-618. 10.1021/np9803528
Properties
HBA 4 HBD 2
HeavyAtoms 34 AlogP 5.92
TPSA 66.76 RotatableBonds 3
FractionCSP3 0.97 Rings 5
AromaticRings 0 AliphaticRings 5