TPCN02302

Name 8(17),13-Labdadien-16,14-olid-18-oic acid
Molecular Formula C20H28O4
Molecular Weight 332.44
CAS Registry Number 851889-94-6
SMILES C=C1CCC2C(C)(C(=O)O)CCCC2(C)C1CCC1=COC(=O)C1
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Pinaceae Pinus armandii Woods 0.003000% J Asian Nat Prod Res 7, 259-264 (2005). 10.1080/10286020410001690163
Properties
HBA 4 HBD 1
HeavyAtoms 24 AlogP 4.46
TPSA 63.60 RotatableBonds 4
FractionCSP3 0.70 Rings 3
AromaticRings 0 AliphaticRings 3