TPCN02889

Name 16,17-dinorpisferal A
Molecular Formula C18H24O2
Molecular Weight 272.39
CAS Registry Number 1257427-67-0
SMILES Cc1cc2c(cc1O)C1(C=O)CCCC(C)(C)C1CC2
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Salvia digitaloides Roots 0.000180% J Agric Food Chem 58, 12157-12161 (2010). 10.1021/jf103366g
Properties
HBA 2 HBD 1
HeavyAtoms 20 AlogP 3.91
TPSA 37.30 RotatableBonds 1
FractionCSP3 0.61 Rings 3
AromaticRings 1 AliphaticRings 2