CHEBI:131593 - 3-deoxy-D-glycero-β-D-galacto-nonulosonic acid

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ChEBI Name 3-deoxy-D-glycero-β-D-galacto-nonulosonic acid ChEBI ID CHEBI:131593 ChEBI ASCII Name 3-deoxy-D-glycero-beta-D-galacto-nonulosonic acid Definition A deaminoneuraminic acid in which the anomeric centre has β-configuration. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C9H16O9 Net Charge 0 Average Mass 268.218 Monoisotopic Mass 268.07943 InChI InChI=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)/t3-,4+,5+,6+,7+,9-/m0/s1 InChIKey CLRLHXKNIYJWAW-YOQZMRDMSA-N SMILES O1[C@@]([C@@H]([C@@H](CO)O)O)([C@H](O)[C@@H](O)C[C@]1(C(O)=O)O)[H] Metabolite of Species Details Bacteroides thetaiotaomicron (NCBI:txid818) See: PubMed Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. View more via ChEBI Ontology ChEBI Ontology Outgoing 3-deoxy-D-glycero-β-D-galacto-nonulosonic acid (CHEBI:131593) has role bacterial metabolite (CHEBI:76969) 3-deoxy-D-glycero-β-D-galacto-nonulosonic acid (CHEBI:131593) is a deaminoneuraminic acid (CHEBI:71429) 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) Incoming CMP-3-deoxy-D-glycero-β-D-galacto-nonulosonic acid (CHEBI:131596) has functional parent 3-deoxy-D-glycero-β-D-galacto-nonulosonic acid (CHEBI:131593) 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) Synonyms Sources 2-keto-3-deoxy-D-glycero-β-D-galacto-nononic acid ChEBI β-KDN ChEBI deamino-β-neuraminic acid ChEBI WURCS=2.0/1,1,0/[Aad21122h-2b_2-6]/1/ GlyTouCan Manual Xrefs Databases CPD-10734 MetaCyc G28553JC GlyTouCan G28553JC GlyGen View more database links Registry Number Type Source 3555043 Reaxys Registry Number Reaxys Citation Type Source 18986982 PubMed citation Europe PMC Last Modified 20 April 2021