TPCN01538

Name (+)-8-Acetyl-13-O-ethyl-piptocarphol
Molecular Formula C19H26O8
Molecular Weight 382.41
CAS Registry Number 103444-96-8
SMILES CCOCC1=C2C(=CC3(C)CCC(O)(O3)C(C)(O)CC2OC(C)=O)OC1=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Pseudelephantopus spicatus Aerial parts 0.000333% J Ethnopharmacol 137(1): 875-879.(2011) 10.1016/j.jep.2011.07.008
Properties
HBA 8 HBD 2
HeavyAtoms 27 AlogP 1.10
TPSA 111.52 RotatableBonds 4
FractionCSP3 0.68 Rings 3
AromaticRings 0 AliphaticRings 3