TPCN00953

Name 9??-acetoxy cumambrin A
Molecular Formula C19H24O7
Molecular Weight 364.39
CAS Registry Number 198065-77-9
SMILES C=C1C(=O)OC2C1C(OC(C)=O)C(OC(C)=O)C(C)(O)C1CC=C(C)C21
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Anthemis carpatica Whole plants 0.007368% Z Naturforsch C J Biosci 57(9-10): 769-772.(2002) 10.1515/znc-2002-9-1001
Properties
HBA 7 HBD 1
HeavyAtoms 26 AlogP 1.29
TPSA 99.13 RotatableBonds 2
FractionCSP3 0.63 Rings 3
AromaticRings 0 AliphaticRings 3