ISORHAMNETIN-3-O-NEOHESPERIDOSIDE
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 44258018
Name
ISORHAMNETIN-3-O-NEOHESPERIDOSIDE
IUPAC name
3-(((2S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2S,3S,5R)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one
SMILES
CC1[C@@H](C([C@@H]([C@@H](O1)OC2[C@@H](OC([C@H](C2O)O)CO)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)O)O)O
Molecular formula
C28H32O16
Molecular weight
624.55 g/mol
Monoisotopic mass
624.1690 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Parietaria officinalis L. | flower | - |
Budzianowski, J., Skrzypczak, L., Walkowiak, D. (1985). Flavonoids of Parietaria officinalis. J Nat Prod, 48(2), 336-337 doi:10.1021/np50038a033
|
| Urtica dioica L. | - | 150 ppm |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|