TPCN02976

Name Dihydroneotanshinlactone
Molecular Formula C17H14O3
Molecular Weight 266.30
CAS Registry Number 1257650-95-5
SMILES Cc1cccc2c1ccc1c3c(c(=O)oc12)C(C)CO3
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Salvia digitaloides Roots 0.000127% J Agric Food Chem 58, 12157-12161 (2010). 10.1021/jf103366g
Properties
HBA 3 HBD 0
HeavyAtoms 20 AlogP 3.75
TPSA 39.44 RotatableBonds 0
FractionCSP3 0.24 Rings 4
AromaticRings 3 AliphaticRings 1