CYANIDIN-3-GLUCOSYL-RUTINOSIDE
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 44256730
Name
CYANIDIN-3-GLUCOSYL-RUTINOSIDE
IUPAC name
3-(((2S,5S)-4,5-dihydroxy-3-(((2S,3R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-6-((((2R,4S,5R)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium
SMILES
CC1[C@@H]([C@@H](C([C@@H](O1)OCC2[C@H](C(C([C@@H](O2)OC3=C([O+]=C4C=C(C=C(C4=C3)O)O)C5=CC(=C(C=C5)O)O)O[C@H]6[C@@H](C([C@@H](C(O6)CO)O)O)O)O)O)O)O)O
Molecular formula
C33H41O20+
Molecular weight
757.67 g/mol
Monoisotopic mass
757.2186 Da
Pathway:
Superclass:
Class:
Glycoside:
Yes
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Rubus idaeus L. subsp. idaeus | - | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|