TPCN02129

Name 1,3-epi-granilin
Molecular Formula C15H20O4
Molecular Weight 264.32
CAS Registry Number 1559063-66-9
SMILES C=C1C(=O)OC2CC3(C)C(O)CC(O)C(=C)C3CC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Carpesium abrotanoides Whole plants 0.000083% Natural Product Research, (2021). 10.1080/14786419.2021.1955881
Properties
HBA 4 HBD 2
HeavyAtoms 19 AlogP 1.18
TPSA 66.76 RotatableBonds 0
FractionCSP3 0.67 Rings 3
AromaticRings 0 AliphaticRings 3