KAEMPFEROL-3-O-RUTINOSIDE-7-O-SOPHOROSIDE
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 44258853
Name
KAEMPFEROL-3-O-RUTINOSIDE-7-O-SOPHOROSIDE
IUPAC name
7-(((2S,4S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-3-(((2S,5S)-3,4,5-trihydroxy-6-((((2R,4S,5R)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
SMILES
CC1[C@@H]([C@@H](C([C@@H](O1)OCC2[C@H](C(C([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O[C@H]5C([C@H]([C@@H](C(O5)CO)O)O)O[C@H]6C([C@H]([C@@H](C(O6)CO)O)O)O)C7=CC=C(C=C7)O)O)O)O)O)O)O
Molecular formula
C39H50O25
Molecular weight
918.80 g/mol
Monoisotopic mass
918.2641 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Equisetum arvense L. | aerial parts | - |
Jim Duke's personal files.
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