TPCN03169

Name Salviamine B
Molecular Formula C18H13NO3
Molecular Weight 291.31
CAS Registry Number 874286-55-2
SMILES CC(=O)c1c(O)c2ccc3c(C)cccc3c2c2ocnc12
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Salvia yunnanensis Roots 0.000037% J Nat Prod 69, 93-96 (2006). 10.1021/np050368f
Properties
HBA 4 HBD 1
HeavyAtoms 22 AlogP 4.35
TPSA 63.33 RotatableBonds 1
FractionCSP3 0.11 Rings 4
AromaticRings 4 AliphaticRings 0