GLUCOFRANGULIN-B

Structure

2D structure of GLUCOFRANGULIN-B
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 46173833

Names and identifiers

Name

GLUCOFRANGULIN-B

IUPAC name

3-(((3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-3-yl)oxy)-8-hydroxy-6-methyl-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)anthracene-9,10-dione

SMILES

CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@@]5(COC[C@@]5(CO)O)O

General information

Molecular formula

C26H28O14

Molecular weight

564.50 g/mol

Monoisotopic mass

564.1479 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Rumex crispus L. root -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.