TPCN06169

Name 3??,19??,23-trihydroxy-6-oxo-olean-12-en-28-oic acid
Molecular Formula C30H46O6
Molecular Weight 502.69
CAS Registry Number 833486-53-6
SMILES CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5C(=O)CC43C)C2C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Rubiaceae Uncaria tomentosa Stems 0.000419% Chem Pharm Bull (Tokyo) . 2004 Oct;52(10):1258-61 10.1248/cpb.52.1258
Properties
HBA 6 HBD 4
HeavyAtoms 36 AlogP 4.36
TPSA 115.06 RotatableBonds 2
FractionCSP3 0.87 Rings 5
AromaticRings 0 AliphaticRings 5