TPCN03253

Name Isosalviamine C
Molecular Formula C23H19NO4
Molecular Weight 373.41
CAS Registry Number 874286-60-9
SMILES COC(=O)CCc1nc2c(o1)c1c(C)coc1c1ccc3c(C)cccc3c12
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Salvia yunnanensis Roots 0.000009% J Nat Prod 69, 93-96 (2006). 10.1021/np050368f
Properties
HBA 5 HBD 0
HeavyAtoms 28 AlogP 5.60
TPSA 65.47 RotatableBonds 3
FractionCSP3 0.22 Rings 5
AromaticRings 5 AliphaticRings 0