TPCN03175

Name 5-methyl-5-(4,8,12-trimethyl-tridecyl)-dihydro-furan-2-one
Molecular Formula C21H40O2
Molecular Weight 324.55
CAS Registry Number 690657-08-0
SMILES CC(C)CCCC(C)CCCC(C)CCCC1(C)CCC(=O)O1
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Hypericaceae Hypericum perforatum Aerial parts 0.000036% Nat Prod Res 18, 15-19 (2004). 10.1080/1478641031000111552
Properties
HBA 2 HBD 0
HeavyAtoms 23 AlogP 6.52
TPSA 26.30 RotatableBonds 12
FractionCSP3 0.95 Rings 1
AromaticRings 0 AliphaticRings 1