TPCN02462

Name Salvioccidentalin
Molecular Formula C20H20O5
Molecular Weight 340.38
CAS Registry Number 1374791-88-4
SMILES CC1C2=C(CCC13CC=CC1C(=O)OCC13)C(=O)OC2c1ccoc1
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Salvia occidentalis Aerial parts 0.001120% Molecules 16, 9109-9115 (2011). 10.3390/molecules16119109
Properties
HBA 5 HBD 0
HeavyAtoms 25 AlogP 3.34
TPSA 65.74 RotatableBonds 1
FractionCSP3 0.50 Rings 5
AromaticRings 1 AliphaticRings 4