TPCN01724

Name Ixerin M
Molecular Formula C26H36O11
Molecular Weight 524.56
CAS Registry Number 101153-66-6
SMILES C=C1CC(OC(=O)C(O)C(C)C)C2C(=C)C(=O)OC2C2C(=C)C(OC3OC(CO)C(O)C(O)C3O)CC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Ixeris dentata Whole plants 0.000167% Planta Med 77(4): 380-382.(2011) 10.1055/s-0030-1250369
Asteraceae Ixeris dentata Roots 0.000083% Arch Pharm Res 29, 937-941(2006) 10.1002/cbdv.201700144
Properties
HBA 11 HBD 5
HeavyAtoms 37 AlogP -0.65
TPSA 172.21 RotatableBonds 6
FractionCSP3 0.69 Rings 4
AromaticRings 0 AliphaticRings 4