TPCN01122

Name Eupalinilides H
Molecular Formula C20H25ClO7
Molecular Weight 412.87
CAS Registry Number 757202-23-6
SMILES C=C1C(=O)OC2C1C(OC(=O)C(C)=CC)CC(O)(CCl)C1C(O)C3OC3(C)C21
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Eupatorium lindleyanum Whole plants 0.002091% J Nat Prod 67(9): 1470-1475.(2004) 10.1021/np040023h
Properties
HBA 7 HBD 2
HeavyAtoms 28 AlogP 1.10
TPSA 105.59 RotatableBonds 3
FractionCSP3 0.70 Rings 4
AromaticRings 0 AliphaticRings 4