IXERIN D
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 21636136
Name
IXERIN D
IUPAC name
(3aS,6R,6aR,8S,9aR,9bS)-6-hydroxy-6-methyl-3,9-dimethylene-8-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)decahydroazuleno[4,5-b]furan-2(3H)-one
SMILES
C[C@]1(CC[C@@H]2[C@@H]([C@@H]3[C@H]1C[C@@H](C3=C)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC(=O)C2=C)O
Molecular formula
C21H30O9
Molecular weight
426.46 g/mol
Monoisotopic mass
426.1890 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Hypochaeris radicata L. | - | - |
Sesquiterpenoids as chemosystematic markers in the subtribe Hypochaeridinae (Lactuceae, Asteraceae) doi:10.1016/j.bse.2005.08.001
|