**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

Malvidin-3-O-beta-D-galactoside

Properties Image MNX_ID MNXM1583652 reference chebi:177071 formula C23H25O12 global charge 1 mol weight 493.441 InChIKey PXUQTDZNOHRWLI-XSEKTIEYSA-O InChI InChI=1S/C23H24O12/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/p+1/t17-,19+,20+,21-,23-/m1/s1 SMILES COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc(OC)c1O MNX internals InChI (mnx) InChI=1/C23H24O12/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/t17-,19+,20+,21-,23-/m1/s1 SMILES (mnx) [CH3:1][O:31][c:14]1[cH:3][c:9](-[c:22]2[c:16]([O:34][C@H:23]3[C@H:21]([OH:30])[C@@H:20]([OH:29])[C@@H:19]([OH:28])[C@@H:17]([CH2:8][OH:24])[O:35]3)[cH:7][c:11]3[c:12]([OH:26])[cH:5][c:10]([OH:25])[cH:6][c:13]3[o+:33]2)[cH:4][c:15]([O:32][CH3:2])[c:18]1[OH:27]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
CHEBI:177071 chebi:177071 PXUQTDZNOHRWLI-XSEKTIEYSA-O	Malvidin-3-O-beta-D-galactoside (2S,3R,4S,5R,6R)-2-[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
hmdb:HMDB0038010 PXUQTDZNOHRWLI-UHFFFAOYSA-O	Malvidin 3-galactoside 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1lambda⁴-chromen-1-ylium Malvidin 3-O-beta-D-galactopyranoside Malvidin 3-galactoside, chloride, (D)-isomer Primulin Uliginosin oenin
hmdb:HMDB38010	secondary/obsolete/fantasy identifier