CYANIDIN-3-O-BETA-D-GLUCOSIDE

Structure

2D structure of CYANIDIN-3-O-BETA-D-GLUCOSIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 9955335

Names and identifiers

Name

CYANIDIN-3-O-BETA-D-GLUCOSIDE

IUPAC name

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

SMILES

C1=CC(=C(C=C1C3=C(C=C2C(=CC(=CC2=[O+]3)O)O)O[C@@H]4[C@H]([C@@H]([C@H]([C@@H](O4)CO)O)O)O)O)O

General information

Molecular formula

C21H21O11+

Molecular weight

449.39 g/mol

Monoisotopic mass

449.1078 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Alcea rosea L. leaf -
Kasumov, M.A. (1984). Red dye from the hollyhock and its use in the food industry. Dokl Akad Nauk Az Ssr, 40(6), 76-79
Daucus carota L. cell culture -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Rubus idaeus L. subsp. idaeus fruit -
Jeffery B. Harborne and H. Baxter, eds. 1983. Phytochemical Dictionary. A Handbook of Bioactive Compounds from Plants. Taylor & Frost, London. 791 pp.
Vaccinium myrtillus L. fruit -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Vaccinium myrtillus L. leaf 342-684 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.