TPCN04111

Name Schefflerins G
Molecular Formula C36H62O9
Molecular Weight 638.88
CAS Registry Number 1345674-35-2
SMILES CC(=CCCC(C)(O)C1CCC2(C)C1CCC1C3(C)CCC(O)C(C)(C)C3C(OC3OC(CO)C(O)C(O)C3O)CC12C)CO
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Schefflera arboricola Leaves 0.000057% Chem Pharm Bull (Tokyo) 58, 1343-1348 (2010). 10.1248/cpb.58.1343
Properties
HBA 9 HBD 7
HeavyAtoms 45 AlogP 3.30
TPSA 160.07 RotatableBonds 8
FractionCSP3 0.94 Rings 5
AromaticRings 0 AliphaticRings 5