QUERCETIN-7-O-BETA-D-GLUCOSIDE-3-O-ALPHA-D-SOPHOROSIDE

Structure

2D structure of QUERCETIN-7-O-BETA-D-GLUCOSIDE-3-O-ALPHA-D-SOPHOROSIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js.

Names and identifiers

Name

QUERCETIN-7-O-BETA-D-GLUCOSIDE-3-O-ALPHA-D-SOPHOROSIDE

IUPAC name

3-(((2S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2S,3R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-(((2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one

SMILES

C1=CC(=C(C=C1C3=C(C(=O)C2=C(C=C(C=C2O3)O[C@@H]4[C@H]([C@@H]([C@H]([C@H](CO)O4)O)O)O)O)O[C@H]5C(C([C@@H](C(O5)CO)O)O)O[C@H]6[C@@H](C([C@@H](C(O6)CO)O)O)O)O)O

General information

Molecular formula

C33H40O22

Molecular weight

788.66 g/mol

Monoisotopic mass

788.2011 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Mutarda arvensis (L.) D.A.German leaf -
Durkee, A.B., Harrbone, J.B. (1973). Flavonol glycosides in Brassica and Sinapis. Phytochemistry, 12, 1085-1089 doi:10.1016/0031-9422(73)85020-4