TPCN01274

Name 6-deoxychamissonolide
Molecular Formula C17H24O5
Molecular Weight 308.37
CAS Registry Number 78798-42-2
SMILES C=C1C(=O)OC2CC(C)C3C(OC(C)=O)CC(O)C3(C)CC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Inula aucheriana Aerial parts 0.001000% An Acad Bras Cienc 87(2): 777-785.(2015) 10.1590/0001-3765201520140063
Properties
HBA 5 HBD 1
HeavyAtoms 22 AlogP 1.83
TPSA 72.83 RotatableBonds 1
FractionCSP3 0.76 Rings 3
AromaticRings 0 AliphaticRings 3