TPCN02158

Name 13-dimethoxyeudesma-5(6),7(11)-eudesmadien-12,8-olide
Molecular Formula C17H24O4
Molecular Weight 292.38
CAS Registry Number 1394395-26-6
SMILES COC(OC)C1=C2C=C3C(C)CCCC3(C)CC2OC1=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Inula helenium Roots 0.001787% Bioorganic Chemistry 114, (2021). 10.1016/j.bioorg.2021.105066
Properties
HBA 4 HBD 0
HeavyAtoms 21 AlogP 2.98
TPSA 44.76 RotatableBonds 3
FractionCSP3 0.71 Rings 3
AromaticRings 0 AliphaticRings 3