| 2D Structure | |
| CID | 176457 |
| Target | / |
| IUPAC Name | (2S,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;chloride |
| InChI | InChI=1S/C21H20O11.ClH/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);1H/t16-,17+,18+,19-,21-;/m1./s1 |
| InChI Key | YTMNONATNXDQJF-QSLGVYCOSA-N |
| Canonical SMILES | C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O.[Cl-] |
| Isomeric SMILES | C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)O)O)O.[Cl-] |
| Molecular Formula | C21H21ClO11 |
| Molecular Weight | 484.8 |
| synonyms | ['27661-36-5', 'Idaein chloride', 'Ideanin', 'Idein chloride', 'Ideain', 'Idein', 'Cyanidin 3-galactoside chloride', 'Cyanidin 3-O-galactoside chloride', 'Idaein', 'UNII-FC7L938Y12', 'FC7L938Y12', 'cyanidin-3-o-galactoside', 'Cyanidin 3-O-beta-galactopyranoside chloride', "3-(Galactosyloxy)-3',4',5,7-tetrahydroxyflavylium chloride", 'Cyanidin 3-O-beta-D-Galactopyranoside Chloride', '1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-(beta-d-galactopyranosyloxy)-5,7-dihydroxy-, chloride', '2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-chromeniumyl beta-D-galactopyranoside chloride', 'Cy3-gal', 'Cyanidin chloride 3-galactoside', 'CYANIDIN-3-GALACTOSIDE CHLORIDE', 'Cyanidin-3-O-galactoside chloride', 'Cyanidin chloride 3-galactoside [MI]', '2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)chromenylium chloride', 'CHEBI:37664', 'Cyanidin-3-O-galactoside (chloride)', '(2S,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;chloride', '1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-(beta-D-galactopyranosyloxy)-5,7-dihydroxy-, chloride (1:1)', 'cyanidin 3-O-beta-D-galactoside chloride', 'Cyanidin 3-O-b-D-Galactopyranoside Chloride', 'MFCD00270387', "3-(beta-D-galactopyranosyloxy)-3',4',5,7-tetrahydroxyflavylium chloride", 'cyanidin 3-O-|A-D-galactoside chloride', 'Idaein chloride, HPLC Grade', 'Cyanidin galactoside; Cyanindin-3-Gal; Idaein; Ideain; Ideanin', 'SCHEMBL316825', 'CHEMBL591992', 'HY-N4142R', 'HY-N4142', 'Idaein chloride, >=90% (HPLC)', 'MSK157003', 'AKOS025311473', 'AC-34781', 'AS-78164', 'FC137844', '1ST157003', 'CS-0032217', 'Cyanidin-3-O-galactoside (chloride) (Standard)', 'Cyanidin 3-O- beta -D-Galactopyranoside Chloride', 'Idaein chloride;Cyanidin-3-O-galactoside chloride', 'CYANIDIN 3-O-.BETA.-GALACTOPYRANOSIDE CHLORIDE', 'CYANIDIN 3-O-.BETA.-D-GALACTOPYRANOSIDE CHLORIDE', '1-BENZOPYRYLIUM, 2-(3,4-DIHYDROXYPHENYL)-3-(.BETA.-D-GALACTOPYRANOSYLOXY)-5,7-DIHYDROXY-, CHLORIDE', '1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-(|A-D-galactopyranosyloxy)-5,7-dihydroxy-, chloride (1:1)', '1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-(ss-D-galactopyranosyloxy)-5,7-dihydroxy-, chloride (1:1)'] |
From Pubchem