TPCN03296

Name Sceptrumlabdalactone B
Molecular Formula C21H32O4
Molecular Weight 348.48
CAS Registry Number 1383441-75-5
SMILES C=C1CCC2C(C)(C)CCCC2(C)C1CC(O)C1=CC(OC)OC1=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Zingiberaceae Alpinia pahangensis Subterraneous stems 0.001000% Planta Med 2013; 79: 1775–1780 10.1055/s-0033-1351075
Properties
HBA 4 HBD 1
HeavyAtoms 25 AlogP 3.99
TPSA 55.76 RotatableBonds 4
FractionCSP3 0.76 Rings 3
AromaticRings 0 AliphaticRings 3