QUERCETIN-3-O-ALPHA-L-RHAMNOPYRANOSIDE(1-2)BETA-D-GALACTOPYRANOSYL-7-O-BETA-D-GLUCOSIDE

Structure

2D structure of QUERCETIN-3-O-ALPHA-L-RHAMNOPYRANOSIDE(1-2)BETA-D-GALACTOPYRANOSYL-7-O-BETA-D-GLUCOSIDE
2D structure
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3D model

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

Names and identifiers

Name

QUERCETIN-3-O-ALPHA-L-RHAMNOPYRANOSIDE(1-2)BETA-D-GALACTOPYRANOSYL-7-O-BETA-D-GLUCOSIDE

IUPAC name

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

SMILES

C3(=C(C(C1=C(C=C(C=C1O)O[C@@H]2[C@H]([C@@H]([C@H]([C@H](CO)O2)O)O)O)O3)=O)O[C@H]5[C@@H]([C@H]([C@H]([C@@H](CO[C@H]4[C@@H]([C@@H]([C@H]([C@H](C)O4)O)O)O)O5)O)O)O)C6=CC(=C(C=C6)O)O

General information

Molecular formula

C33H40O21

Molecular weight

772.66 g/mol

Monoisotopic mass

772.2062 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Blackstonia perfoliata (L.) Huds. subsp. perfoliata leaf -
Kaouadji, M., Doucoure, A., Mariotte, A.M., Chulia, A.J., Thomasson, F. (1990). Flavonol triglycosides from Blackstonia perfoliata. Phytochemistry, 29(4), 1283-1286 doi:10.1016/0031-9422(90)85443-j