TPCN06227

Name Cumingianol A
Molecular Formula C32H54O6
Molecular Weight 534.78
CAS Registry Number 1346240-39-8
SMILES CC(=O)OC1CC2C(C)(C)C(O)CCC2(C)C2CCC34CC3(CCC4C(C)CC(O)C(O)C(C)(C)O)C12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Meliaceae Dysoxylum cumingianum Leaves 0.000172% Phytochemistry . 2011 Dec;72(17):2205-11 10.1016/j.phytochem.2011.08.002
Properties
HBA 6 HBD 4
HeavyAtoms 38 AlogP 4.85
TPSA 107.22 RotatableBonds 6
FractionCSP3 0.97 Rings 5
AromaticRings 0 AliphaticRings 5