TPCN04165

Name Aphanamgrandins F
Molecular Formula C30H45NO4
Molecular Weight 483.69
CAS Registry Number 1392308-50-7
SMILES CC(C)=CC(=O)CC(C)C1CCC2(C)C3=CCC4C(C)(C)C(=O)C(O)(C(N)=O)C4(C)C3CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Meliaceae Aphanamixis grandifolia Stems 0.000021% Phytochemistry 80, 148-155 (2012). 10.1016/j.phytochem.2012.05.017
Properties
HBA 5 HBD 3
HeavyAtoms 35 AlogP 5.16
TPSA 97.46 RotatableBonds 5
FractionCSP3 0.77 Rings 4
AromaticRings 0 AliphaticRings 4