TPCN01294

Name Eupalinilides I
Molecular Formula C20H26O9
Molecular Weight 410.42
CAS Registry Number 757202-25-8
SMILES C=C1C(=O)OC2C1C(OC(=O)C(C)=CCO)CC(O)(CO)C1C(O)C3OC3(C)C21
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Eupatorium lindleyanum Whole plants 0.000864% J Nat Prod 67(9): 1470-1475.(2004) 10.1021/np040023h
Properties
HBA 9 HBD 4
HeavyAtoms 29 AlogP -1.17
TPSA 146.05 RotatableBonds 4
FractionCSP3 0.70 Rings 4
AromaticRings 0 AliphaticRings 4