TPCN02792

Name 7-oxo-12alpha, 13beta,15-trihydroxyabiet-8(14)-en-18-oic acid
Molecular Formula C20H30O6
Molecular Weight 366.45
CAS Registry Number 1073175-19-5
SMILES CC1(C(=O)O)CCCC2(C)C3CC(O)C(O)(C(C)(C)O)C=C3C(=O)CC12
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Pinaceae Pinus koraiensis Whole plants 0.000267% Fitoterapia 79, 179-181 (2008). 10.1016/j.fitote.2007.11.015
Properties
HBA 6 HBD 4
HeavyAtoms 26 AlogP 1.67
TPSA 115.06 RotatableBonds 2
FractionCSP3 0.80 Rings 3
AromaticRings 0 AliphaticRings 3