CHEBI:58230 - 2-(β-D-glucopyranosyluronate)-D-glucuronate(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-(β-D-glucopyranosyluronate)-D-glucuronate(2−)
ChEBI ID CHEBI:58230
ChEBI ASCII Name 2-(beta-D-glucopyranosyluronate)-D-glucuronate(2-)
Definition A carbohydrate acid anion arising from deprotonation of both carboxy groups of 2-(β-D-glucopyranosyluronic acid)-D-glucuronic acid; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C12H16O13
Net Charge -2
Average Mass 368.24760
Monoisotopic Mass 368.06019
InChI InChI=1S/C12H18O13/c13-1-2(14)7(10(20)21)24-12(5(1)17)25-8-4(16)3(15)6(9(18)19)23-11(8)22/h1-8,11-17,22H,(H,18,19)(H,20,21)/p-2/t1-,2-,3-,4-,5+,6-,7-,8+,11+,12-/m0/s1
InChIKey IMNADAQGVSDVMI-CCLDAEICSA-L
SMILES O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing 2-(β-D-glucopyranosyluronate)-D-glucuronate(2−) (CHEBI:58230) is a carbohydrate acid anion (CHEBI:33721)
2-(β-D-glucopyranosyluronate)-D-glucuronate(2−) (CHEBI:58230) is a dicarboxylic acid dianion (CHEBI:28965)
2-(β-D-glucopyranosyluronate)-D-glucuronate(2−) (CHEBI:58230) is conjugate base of 2-(β-D-glucopyranosyluronic acid)-D-glucuronic acid (CHEBI:17676)
Incoming 2-(β-D-glucopyranosyluronic acid)-D-glucuronic acid (CHEBI:17676) is conjugate acid of 2-(β-D-glucopyranosyluronate)-D-glucuronate(2−) (CHEBI:58230)
IUPAC Name
β-D-glucopyranuronosyl-(1→2)-β-D-glucopyranuronate
Synonyms Sources
2-(β-D-glucopyranosyluronate)-D-glucuronate ChEBI
2-(β-D-glucopyranosyluronate)-D-glucuronate dianion ChEBI
2-(β-D-glucuronosyl)-D-glucuronate UniProt
2-O-β-D-glucopyranuronosyl-β-D-glucopyranuronate IUPAC
Last Modified
13 November 2017