TPCN02738

Name (-)-Barbatusol
Molecular Formula C20H28O2
Molecular Weight 300.44
CAS Registry Number 88515-76-8
SMILES CC(C)c1cc2c(c(O)c1O)CC1=CCCC(C)(C)C1CC2
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Rosmarinus officinalis Whole plants 0.000325% Phytomedicine 23, 1671-1679 (2016). 10.1016/j.phymed.2016.09.008
Properties
HBA 2 HBD 2
HeavyAtoms 22 AlogP 5.07
TPSA 40.46 RotatableBonds 1
FractionCSP3 0.60 Rings 3
AromaticRings 1 AliphaticRings 2