CYANIDIN-3-O-BETA-(6''-O-OXALYL)-GLUCOSIDE

Structure

2D structure of CYANIDIN-3-O-BETA-(6''-O-OXALYL)-GLUCOSIDE
2D structure
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3D model

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

Names and identifiers

Name

CYANIDIN-3-O-BETA-(6''-O-OXALYL)-GLUCOSIDE

IUPAC name

3-(((2R,3S,4R,5R,6S)-6-(((carboxycarbonyl)oxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium

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)COC(C(O)=O)=O)O)O)O)O)O

General information

Molecular formula

C23H21O14+

Molecular weight

521.41 g/mol

Monoisotopic mass

521.0926 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Anacamptis morio (L.) R.M.Bateman, Pridgeon & M.W.Chase flower -
Strack, D., Busch, E., Wray, V., Grotjahn, L., Klein, E. (1986). Cyanidin 3-oxalylglucoside in orchids. Z Naturforsch Ser C, 41(7/8), 707-711 doi:10.1515/znc-1986-7-808
Anacamptis pyramidalis (L.) Rich. flower -
Strack, D., Busch, E., Wray, V., Grotjahn, L., Klein, E. (1986). Cyanidin 3-oxalylglucoside in orchids. Z Naturforsch Ser C, 41(7/8), 707-711 doi:10.1515/znc-1986-7-808
Dactylorhiza fuchsii (Druce) Soó flower -
Strack, D., Busch, E., Wray, V., Grotjahn, L., Klein, E. (1986). Cyanidin 3-oxalylglucoside in orchids. Z Naturforsch Ser C, 41(7/8), 707-711 doi:10.1515/znc-1986-7-808
Orchis mascula (L.) L. subsp. mascula flower -
Strack, D., Busch, E., Wray, V., Grotjahn, L., Klein, E. (1986). Cyanidin 3-oxalylglucoside in orchids. Z Naturforsch Ser C, 41(7/8), 707-711 doi:10.1515/znc-1986-7-808
Orchis purpurea Huds. flower -
Strack, D., Busch, E., Wray, V., Grotjahn, L., Klein, E. (1986). Cyanidin 3-oxalylglucoside in orchids. Z Naturforsch Ser C, 41(7/8), 707-711 doi:10.1515/znc-1986-7-808
Traunsteinera globosa (L.) Rchb. flower -
Strack, D., Busch, E., Wray, V., Grotjahn, L., Klein, E. (1986). Cyanidin 3-oxalylglucoside in orchids. Z Naturforsch Ser C, 41(7/8), 707-711 doi:10.1515/znc-1986-7-808