CHEBI:132990 - 2,9-dideoxy-9-glutaramido-2,3-dehydo-N-acetylneuraminic acid

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ChEBI Name 2,9-dideoxy-9-glutaramido-2,3-dehydo-N-acetylneuraminic acid
ChEBI ID CHEBI:132990
ChEBI ASCII Name 2,9-dideoxy-9-glutaramido-2,3-dehydo-N-acetylneuraminic acid
Definition N-Acetylneuraminic acid reduced across the 2,3-bond with loss of the hydroxy group at C-2 and in which the 9-hydroxy group is substituted by a glutaramido group.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C16H24N2O10
Net Charge 0
Average Mass 404.370
Monoisotopic Mass 404.14309
InChI InChI=1S/C16H24N2O10/c1-7(19)18-13-8(20)5-10(16(26)27)28-15(13)14(25)9(21)6-17-11(22)3-2-4-12(23)24/h5,8-9,13-15,20-21,25H,2-4,6H2,1H3,(H,17,22)(H,18,19)(H,23,24)(H,26,27)/t8-,9+,13+,14+,15+/m0/s1
InChIKey DLDXETGOWJUNDZ-NIQAVCIQSA-N
SMILES [C@@H]1([C@@](OC(C(O)=O)=C[C@@H]1O)([C@@H]([C@@H](CNC(CCCC(=O)O)=O)O)O)[H])NC(C)=O
Roles Classification
Biological Role(s): hapten
Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
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ChEBI Ontology
Outgoing 2,9-dideoxy-9-glutaramido-2,3-dehydo-N-acetylneuraminic acid (CHEBI:132990) has role hapten (CHEBI:59174)
2,9-dideoxy-9-glutaramido-2,3-dehydo-N-acetylneuraminic acid (CHEBI:132990) is a N-acetylneuraminic acids (CHEBI:21622)
2,9-dideoxy-9-glutaramido-2,3-dehydo-N-acetylneuraminic acid (CHEBI:132990) is a acetamides (CHEBI:22160)
2,9-dideoxy-9-glutaramido-2,3-dehydo-N-acetylneuraminic acid (CHEBI:132990) is a secondary carboxamide (CHEBI:140325)
IUPAC Name
5-acetamido-2,6-anhydro-9-(4-carboxybutanamido)-3,5,9-trideoxy-D-glycero-D-galacto-non-2-enonic acid
Synonym Source
5-acetamido-2,6-anhydro-9-glutaramido-3,5,9-trideoxy-D-glycero-D-galacto-non-2-enonic acid ChEBI
Registry Number Type Source
8365789 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
10399297 PubMed citation Europe PMC
Last Modified
07 March 2018