TPCN05849

Name A??-Neogammacer-22(29)-en-3-ol, 3-acetate, (3??)- (ACI)
Molecular Formula C32H52O2
Molecular Weight 468.77
CAS Registry Number 76582-61-1
SMILES C=C(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCC(OC(C)=O)C(C)(C)C3CCC21C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Urticaceae Pilea cavaleriei Whole plants 0.000080% J Asian Nat Prod Res. 2012;14(11):1032-8. 10.1080/10286020.2012.702760.
Properties
HBA 2 HBD 0
HeavyAtoms 34 AlogP 8.60
TPSA 26.30 RotatableBonds 2
FractionCSP3 0.91 Rings 5
AromaticRings 0 AliphaticRings 5