EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:60189 - 4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonate(2−)

ChEBI IDCHEBI:60189
ChEBI Name4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonate(2−)
Stars
ASCII Name4-(4-deoxy-alpha-D-gluc-4-enosyluronic acid)-D-galacturonate(2-)
DefinitionThe dianion obtained by removal of a proton from both carboxyic acid groups of 4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonic acid.
Last Modified14 August 2018
SubmitterGareth Owen
DownloadsMolfile
FormulaC12H14O12
Net Charge-2
Average Mass350.232
Monoisotopic Mass350.04962
SMILESO=C([O-])C1=C[C@H](O)[C@@H](O)[C@@H](O[C@@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2C(=O)[O-])O1
InChIInChI=1S/C12H16O12/c13-2-1-3(9(17)18)22-12(4(2)14)24-7-5(15)6(16)11(21)23-8(7)10(19)20/h1-2,4-8,11-16,21H,(H,17,18)(H,19,20)/p-2/t2-,4+,5+,6+,7+,8-,11?,12+/m0/s1
InChIKeyLLVVMXFNKAHVEZ-GAWNPARCSA-L
ChEBI Ontology
Outgoing Relation(s)
4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonate(2−) (CHEBI:60189) is a carbohydrate acid anion (CHEBI:33721)
4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonate(2−) (CHEBI:60189) is a dicarboxylic acid dianion (CHEBI:28965)
4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonate(2−) (CHEBI:60189) is conjugate base of 4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonic acid (CHEBI:27450)
Incoming Relation(s)
4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonic acid (CHEBI:27450) is conjugate acid of 4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonate(2−) (CHEBI:60189)
IUPAC Name 
4-O-(4-deoxy-β-L-threo-hex-4-enopyranuronosyl)-D-galactopyranuronate
Synonyms  Source
4-(4-deoxy-α-D-gluc-4-enosyluronic acid)-D-galacturonate dianionChEBI
4-(4-deoxy-α-D-galact-4-enuronosyl)-D-galacturonate(2−)ChEBI
4-(4-deoxy-α-D-galact-4-enuronosyl)-D-galacturonate dianionChEBI
4-(4-deoxy-α-D-galact-4-enosyluronic acid)-D-galacturonate(2−)ChEBI
4-(4-deoxy-α-D-galact-4-enosyluronic acid)-D-galacturonate dianionChEBI
UniProt Name  Source
4-(4-deoxy-α-D-galact-4-enuronosyl)-D-galacturonateUniProt