TPCN00882

Name Karatavicinol
Molecular Formula C24H32O5
Molecular Weight 400.52
CAS Registry Number 25374-66-7
SMILES CC(=CCOc1ccc2ccc(=O)oc2c1)CCC=C(C)CCC(O)C(C)(C)O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Apiaceae Heptaptera anatolica Roots 0.018000% Molecules 24(6).(2019) 10.3390/molecules24061153
Properties
HBA 5 HBD 2
HeavyAtoms 29 AlogP 4.76
TPSA 79.90 RotatableBonds 10
FractionCSP3 0.46 Rings 2
AromaticRings 2 AliphaticRings 0