TPCN01632

Name Toluccanolides A
Molecular Formula C15H20O3
Molecular Weight 248.32
CAS Registry Number 65563-79-3
SMILES CC1=C2C(CC3=CCCC(C)C3(C)C2O)OC1=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Chloranthaceae Ligularia virgaurea Whole plants 0.000250% Planta Med 70(5): 479-482.(2004) 10.1055/s-2004-818983
Properties
HBA 3 HBD 1
HeavyAtoms 18 AlogP 2.36
TPSA 46.53 RotatableBonds 0
FractionCSP3 0.67 Rings 3
AromaticRings 0 AliphaticRings 3