TPCN05061

Name Leuctriterpencoside;Leuctriterpencoside?
Molecular Formula C36H54O8
Molecular Weight 614.82
CAS Registry Number 2349387-75-1
SMILES CC1OC(OC(=O)C23CCC(C)(C=O)CC2C2=CCC4C5(C)CCC(=O)C(C)(C)C5CCC4(C)C2(C)CC3)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Leucas zeylanica Stems 0.000775% Nat Prod Res, 1-5 (2019) 10.1080/14786419.2019.1566820
Lamiaceae Leucas zeylanica Stems 0.000775% None 10.1080/14786419.2019.1566820
Properties
HBA 8 HBD 3
HeavyAtoms 44 AlogP 4.91
TPSA 130.36 RotatableBonds 3
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6