QUERCETIN-3-O-ALPHA-L-GLUCOPYRANOSYL-7-O-ALPHA-L-RHAMNOPYRANOSIDE

Structure

2D structure of QUERCETIN-3-O-ALPHA-L-GLUCOPYRANOSYL-7-O-ALPHA-L-RHAMNOPYRANOSIDE
2D structure
Drag to rotate, scroll to zoom
3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 49842399

Names and identifiers

Name

QUERCETIN-3-O-ALPHA-L-GLUCOPYRANOSYL-7-O-ALPHA-L-RHAMNOPYRANOSIDE

IUPAC name

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

SMILES

O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC=2C(=O)C=3C(OC2C4=CC=C(O)C(=C4)O)=CC(O[C@H]5O[C@H]([C@H](O)[C@@H](O)[C@H]5O)C)=CC3O)CO

General information

Molecular formula

C27H30O16

Molecular weight

610.52 g/mol

Monoisotopic mass

610.1534 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Arabidopsis thaliana (L.) Heynh. leaf -
Nakabayashi, R., Kusano, M., Kobayashi, M., Tohge, T., Yonekura-sakakibara, K., Kogure, N., Yamazaki, M., Kitajima, M., Saito, K., Takayama, H. (2009). Metabolomics-oriented isolation and structure elucidation of 37 compounds including two anthocyanins from Arabidopsis thaliana Phytochemistry, 70(8), 1017-1029 doi:10.1016/j.phytochem.2009.03.021