TPCN01709

Name (6R)-beta-chamigrenic acid
Molecular Formula C15H22O2
Molecular Weight 234.34
CAS Registry Number 103089-10-7
SMILES C=C1CCCC(C)(C)C12CC=C(C(=O)O)CC2
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Schisandraceae Schisandra chinensis Fruits 0.000176% Molecules 22(11).(2017) 10.3390/molecules22111931
Properties
HBA 2 HBD 1
HeavyAtoms 17 AlogP 3.93
TPSA 37.30 RotatableBonds 1
FractionCSP3 0.67 Rings 2
AromaticRings 0 AliphaticRings 2