TPCN03310

Name Pahangensin C
Molecular Formula C40H58O6
Molecular Weight 634.90
CAS Registry Number 1609651-53-7
SMILES C=C1CCC2C(C)(C)CCCC2(C)C1CC=C(C=O)CC(=O)OC1OC(=O)C(=CCC2C(=C)CCC3C(C)(C)CCCC23C)C1O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Zingiberaceae Alpinia pahangensis Subterraneous stems 0.000350% Planta Med 2013; 79: 1775–1780 10.1055/s-0033-1351075
Properties
HBA 6 HBD 1
HeavyAtoms 46 AlogP 8.59
TPSA 89.90 RotatableBonds 8
FractionCSP3 0.73 Rings 5
AromaticRings 0 AliphaticRings 5