TPCN03086

Name 2-isopropyl-8,8-dimethyl-7,8-dihydrophenanthrene-1,4,5(6H)-trione
Molecular Formula C19H20O3
Molecular Weight 296.37
CAS Registry Number 22521-10-4
SMILES CC(C)C1=CC(=O)c2c(ccc3c2C(=O)CCC3(C)C)C1=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Salvia leriifolia Whole plants 0.000072% Nat Prod Res 30, 1511-1516 (2016). 10.1080/14786419.2015.1115997
Properties
HBA 3 HBD 0
HeavyAtoms 22 AlogP 3.90
TPSA 51.21 RotatableBonds 1
FractionCSP3 0.42 Rings 3
AromaticRings 1 AliphaticRings 2