EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H21O11 |
| Net Charge | +1 |
| Average Mass | 449.388 |
| Monoisotopic Mass | 449.10784 |
| SMILES | OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O |
| InChI | InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17+,18+,19-,21-/m1/s1 |
| InChIKey | RKWHWFONKJEUEF-WVXKDWSHSA-O |
| Roles Classification |
|---|
| Biological Roles: | plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. food component A physiological role played by any substance that is distributed in foodstuffs. It includes materials derived from plants or animals, such as vitamins or minerals, as well as environmental contaminants. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| cyanidin 3-O-β-D-galactoside (CHEBI:27475) has functional parent cyanidin cation (CHEBI:27843) |
| cyanidin 3-O-β-D-galactoside (CHEBI:27475) has role food component (CHEBI:78295) |
| cyanidin 3-O-β-D-galactoside (CHEBI:27475) has role plant metabolite (CHEBI:76924) |
| cyanidin 3-O-β-D-galactoside (CHEBI:27475) is a anthocyanin cation (CHEBI:35218) |
| cyanidin 3-O-β-D-galactoside (CHEBI:27475) is a monosaccharide derivative (CHEBI:63367) |
| cyanidin 3-O-β-D-galactoside (CHEBI:27475) is a β-D-galactoside (CHEBI:28034) |
| cyanidin 3-O-β-D-galactoside (CHEBI:27475) is conjugate acid of cyanidin 3-O-β-D-galactoside betaine (CHEBI:71515) |
| Incoming Relation(s) |
| cyanidin 3-O-β-D-galactoside chloride (CHEBI:37664) has part cyanidin 3-O-β-D-galactoside (CHEBI:27475) |
| cyanidin 3-O-β-D-galactoside betaine (CHEBI:71515) is conjugate base of cyanidin 3-O-β-D-galactoside (CHEBI:27475) |
| IUPAC Name |
|---|
| 3-(β-D-galactopyranosyloxy)-3',4',5,7-tetrahydroxyflavylium |
| Synonym | Source |
|---|---|
| Cyanidin 3-O-galactoside | KEGG COMPOUND |
| Citations |
|---|