CHEBI:65188 - 9-deoxy-9-acetamido-N-acetyl-α-neuraminic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 9-deoxy-9-acetamido-N-acetyl-α-neuraminic acid
ChEBI ID CHEBI:65188
ChEBI ASCII Name 9-deoxy-9-acetamido-N-acetyl-alpha-neuraminic acid
Definition An N-acetylneuraminic acid that is N-acetyl-α-neuraminic acid in which the 9-hydroxy group has been replaced by an acetamido group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C13H22N2O9
Net Charge 0
Average Mass 350.32180
Monoisotopic Mass 350.13253
InChI InChI=1S/C13H22N2O9/c1-5(16)14-4-8(19)10(20)11-9(15-6(2)17)7(18)3-13(23,24-11)12(21)22/h7-11,18-20,23H,3-4H2,1-2H3,(H,14,16)(H,15,17)(H,21,22)/t7-,8+,9+,10+,11+,13+/m0/s1
InChIKey VOVFDZJABRGWTQ-CTAKWSDESA-N
SMILES [H][C@]1(O[C@](O)(C[C@H](O)[C@H]1NC(C)=O)C(O)=O)[C@H](O)[C@H](O)CNC(C)=O
Roles Classification
Biological Role(s): epitope
The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 9-deoxy-9-acetamido-N-acetyl-α-neuraminic acid (CHEBI:65188) has functional parent N-acetylneuraminic acid (CHEBI:17012)
9-deoxy-9-acetamido-N-acetyl-α-neuraminic acid (CHEBI:65188) has role epitope (CHEBI:53000)
9-deoxy-9-acetamido-N-acetyl-α-neuraminic acid (CHEBI:65188) is a N-acetylneuraminic acids (CHEBI:21622)
IUPAC Name
5,9-diacetamido-3,5,9-trideoxy-D-glycero-α-D-galacto-non-2-ulopyranosonic acid
Synonyms Sources
9-deoxy-9-(acetylamino)-N-acetyl-α-neuraminic acid ChEBI
9NAcNeu5Acα ChEBI
Citation Waiting for Citations Type Source
19443021 PubMed citation Europe PMC
Last Modified
20 November 2019