CHEBI:28062 - 2-deoxy-2,3-dehydro-N-acetylneuraminic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-deoxy-2,3-dehydro-N-acetylneuraminic acid
ChEBI ID CHEBI:28062
ChEBI ASCII Name 2-deoxy-2,3-dehydro-N-acetylneuraminic acid
Definition N-Acetylneuraminic acid reduced across the 2,3-bond with loss of the hydroxy group at C-2; it is a minor component of body fluids although abundant in sialuria.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:19548, CHEBI:1073
Supplier Information
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Formula C11H17NO8
Net Charge 0
Average Mass 291.25462
Monoisotopic Mass 291.09542
InChI InChI=1S/C11H17NO8/c1-4(14)12-8-5(15)2-7(11(18)19)20-10(8)9(17)6(16)3-13/h2,5-6,8-10,13,15-17H,3H2,1H3,(H,12,14)(H,18,19)/t5-,6+,8+,9+,10+/m0/s1
InChIKey JINJZWSZQKHCIP-UFGQHTETSA-N
SMILES [H][C@]1(OC(=C[C@H](O)[C@H]1NC(C)=O)C(O)=O)[C@H](O)[C@H](O)CO
ChEBI Ontology
Outgoing 2-deoxy-2,3-dehydro-N-acetylneuraminic acid (CHEBI:28062) is a N-acetylneuraminic acids (CHEBI:21622)
2-deoxy-2,3-dehydro-N-acetylneuraminic acid (CHEBI:28062) is conjugate acid of 2-deoxy-2,3-dehydro-N-acetylneuraminate (CHEBI:229229)
Incoming 2-deoxy-2,3-dehydro-N-acetylneuraminate (CHEBI:229229) is conjugate base of 2-deoxy-2,3-dehydro-N-acetylneuraminic acid (CHEBI:28062)
IUPAC Name
5-acetamido-2,6-anhydro-3,5-dideoxy-D-glycero-D-galacto-non-2-enonic acid
Synonyms Sources
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid KEGG COMPOUND
Neu2en5Ac ChEBI
Manual Xrefs Databases
C04580 KEGG COMPOUND
DAN PDBeChem
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Registry Numbers Types Sources
1324941 Beilstein Registry Number Beilstein
1324941 Reaxys Registry Number Reaxys
24967-27-9 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
11746676 PubMed citation Europe PMC
Last Modified
11 August 2016