TPCN05828

Name Olean-12-en-3??,16??,22??-triol
Molecular Formula C30H50O3
Molecular Weight 458.73
CAS Registry Number 54717-71-4
SMILES CC1(C)CC(O)C2(C)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lecythidaceae Barringtonia asiatica Barks 0.000158% Nat Prod Res. 2012;26(20):1869-75. 10.1080/14786419.2011.619187.
Properties
HBA 3 HBD 3
HeavyAtoms 33 AlogP 6.11
TPSA 60.69 RotatableBonds 0
FractionCSP3 0.93 Rings 5
AromaticRings 0 AliphaticRings 5