TPCN01704

Name Annuolide H
Molecular Formula C20H26O6
Molecular Weight 362.42
CAS Registry Number 887115-13-1
SMILES C=C1C(=O)OC2C1C(OC(=O)C(C)=CC)CC(C)(O)C1C(O)C=C(C)C21
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Helianthus annuus Leaves 0.000180% J Nat Prod 69(5): 795-800.(2006) 10.1021/np060056s
Properties
HBA 6 HBD 2
HeavyAtoms 26 AlogP 1.67
TPSA 93.06 RotatableBonds 2
FractionCSP3 0.60 Rings 3
AromaticRings 0 AliphaticRings 3