DELPHINIDIN-3-(6''-MALONYLGLUCOSIDE)-5-MALONYLGLUCOSIDE

Structure

2D structure of DELPHINIDIN-3-(6''-MALONYLGLUCOSIDE)-5-MALONYLGLUCOSIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 44256901

Names and identifiers

Name

DELPHINIDIN-3-(6''-MALONYLGLUCOSIDE)-5-MALONYLGLUCOSIDE

IUPAC name

5-(((2S,4S,5S)-6-((2-carboxyacetoxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,5S)-6-((2-carboxyacetoxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-7-hydroxy-2-(3,4,5-trihydroxyphenyl)chromenylium

SMILES

C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O[C@H]4C([C@H]([C@@H](C(O4)COC(=O)CC(=O)O)O)O)O)O[C@H]5C(C([C@@H](C(O5)COC(=O)CC(=O)O)O)O)O

General information

Molecular formula

C33H35O23+

Molecular weight

799.62 g/mol

Monoisotopic mass

799.1564 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

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