TPCN01773

Name 6alpha,10alpha-dihydroxy-1-oxoeremophila-7(11),8(9)-dien-12,8-olide
Molecular Formula C15H18O5
Molecular Weight 278.30
CAS Registry Number 790685-49-3
SMILES CC1=C2C(=CC3(O)C(=O)CCC(C)C3(C)C2O)OC1=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Ligularia virgaurea Whole plants 0.000128% Planta Med 70(5): 479-482.(2004) 10.1055/s-2004-818983
Properties
HBA 5 HBD 2
HeavyAtoms 20 AlogP 0.85
TPSA 83.83 RotatableBonds 0
FractionCSP3 0.60 Rings 3
AromaticRings 0 AliphaticRings 3