TPCN02973

Name Bisprioterones B
Molecular Formula C39H46O5
Molecular Weight 594.79
CAS Registry Number 886755-35-7
SMILES CC(C)=CC1Oc2c(O)c(C(C)C)cc3ccc(C)c(c23)C1C1C(C(C)C)=C(O)C(=O)c2c1ccc1c2C(O)CCC1(C)C
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Salvia prionitis Roots 0.000130% Phytochemistry 67, 795-799 (2006). 10.1016/j.phytochem.2005.12.023
Properties
HBA 5 HBD 3
HeavyAtoms 44 AlogP 9.34
TPSA 86.99 RotatableBonds 4
FractionCSP3 0.46 Rings 6
AromaticRings 3 AliphaticRings 3