TPCN01046

Name 11??H,13-dihydroparthenolide
Molecular Formula C15H22O3
Molecular Weight 250.34
CAS Registry Number 2513-76-0
SMILES CC1=CCCC2(C)OC2C2OC(=O)C(C)C2CC1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Achillea collina Aerial parts 0.003333% Z Naturforsch C J Biosci 57(7-8): 568-570.(2002) 10.1515/znc-2002-7-802
Properties
HBA 3 HBD 0
HeavyAtoms 18 AlogP 2.84
TPSA 38.83 RotatableBonds 0
FractionCSP3 0.80 Rings 3
AromaticRings 0 AliphaticRings 3