CHEBI:90988 - 3-deoxy-D-glycero-β-D-galacto-nonulosonate

ChEBI IDCHEBI:90988
ChEBI Name3-deoxy-D-glycero-β-D-galacto-nonulosonate
Stars
ASCII Name3-deoxy-D-glycero-beta-D-galacto-nonulosonate
DefinitionA carbohydrate acid derivative anion obtained by deprotonation of the carboxy group of 3-deoxy-D-glycero-β-D-galacto-nonulosonic acid
Last Modified11 January 2017
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC9H15O9
Net Charge-1
Average Mass267.210
Monoisotopic Mass267.07216
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@](O)(C(=O)[O-])C[C@H](O)[C@H]1O
InChIInChI=1S/C9H16O9/c10-2-4(12)6(14)7-5(13)3(11)1-9(17,18-7)8(15)16/h3-7,10-14,17H,1-2H2,(H,15,16)/p-1/t3-,4+,5+,6+,7+,9-/m0/s1
InChIKeyCLRLHXKNIYJWAW-YOQZMRDMSA-M
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
3-deoxy-D-glycero-β-D-galacto-nonulosonate (CHEBI:90988) has role bacterial metabolite (CHEBI:76969)
3-deoxy-D-glycero-β-D-galacto-nonulosonate (CHEBI:90988) is a carbohydrate acid anion (CHEBI:33721)
3-deoxy-D-glycero-β-D-galacto-nonulosonate (CHEBI:90988) is a monocarboxylic acid anion (CHEBI:35757)
3-deoxy-D-glycero-β-D-galacto-nonulosonate (CHEBI:90988) is conjugate base of 3-deoxy-D-glycero-β-D-galacto-nonulosonic acid (CHEBI:131593)
Incoming Relation(s)
CMP-9-O-acetyl-3-deoxy-D-glycero-β-D-galacto-non-2-ulopyranosonate(2−) (CHEBI:233183) has functional parent 3-deoxy-D-glycero-β-D-galacto-nonulosonate (CHEBI:90988)
3-deoxy-D-glycero-β-D-galacto-nonulosonic acid (CHEBI:131593) is conjugate acid of 3-deoxy-D-glycero-β-D-galacto-nonulosonate (CHEBI:90988)
IUPAC Name 
3-deoxy-D-glycero-β-D-galacto-non-2-ulopyranosonate
Synonyms  Source
2-keto-3-deoxy-D-glycero-D-galacto-nononateSUBMITTER
deamino-β-neuraminateChEBI
β-KDN(1−)ChEBI
UniProt Name  Source
3-deoxy-D-glycero-β-D-galacto-non-2-ulopyranosonateUniProt
Manual XrefsDatabases
CPD-10734MetaCyc
Citations