CYANIN

Structure

2D structure of CYANIN
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 441688

Names and identifiers

Name

CYANIN

IUPAC name

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

SMILES

C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O

General information

Molecular formula

C27H31O16+

Molecular weight

611.53 g/mol

Monoisotopic mass

611.1607 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 -
Uphoff, W. (1979). Anthocyanins in the flowers of european orchids. Experientia, 35, 1013-1014 doi:10.1007/bf01949912
Dactylorhiza sambucina (L.) Soó flower -
Uphoff, W. (1979). Anthocyanins in the flowers of european orchids. Experientia, 35, 1013-1014 doi:10.1007/bf01949912
Neottia ovata (L.) Bluff & Fingerh. flower -
Uphoff, W. (1979). Anthocyanins in the flowers of european orchids. Experientia, 35, 1013-1014 doi:10.1007/bf01949912
Orchis mascula (L.) L. subsp. mascula flower -
Uphoff, W. (1979). Anthocyanins in the flowers of european orchids. Experientia, 35, 1013-1014 doi:10.1007/bf01949912
Orchis purpurea Huds. flower -
Uphoff, W. (1979). Anthocyanins in the flowers of european orchids. Experientia, 35, 1013-1014 doi:10.1007/bf01949912
Rubus idaeus L. subsp. idaeus fruit -
List, P.H. and Horhammer, L., Hager's Handbuch der Pharmazeutischen Praxis, Vols. 2-6, Springer-Verlag, Berlin, 1969-1979.
Sambucus nigra L. fruit -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Viola odorata L. flower 53000 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.