CHEBI:229228 - N-acetyl-2,7-anhydro-α-neuraminate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name N-acetyl-2,7-anhydro-α-neuraminate
ChEBI ID CHEBI:229228
ChEBI ASCII Name N-acetyl-2,7-anhydro-alpha-neuraminate
Definition Major species at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C11H16NO8
Net Charge -1
Average Mass 290.249
Monoisotopic Mass 290.08814
InChI InChI=1S/C11H17NO8/c1-4(14)12-7-5(15)2-11(10(17)18)19-8(6(16)3-13)9(7)20-11/h5-9,13,15-16H,2-3H2,1H3,(H,12,14)(H,17,18)/p-1/t5-,6+,7+,8+,9+,11+/m0/s1
InChIKey NCMJSVDTRDLWJE-YRMXFSIDSA-M
SMILES [C@@H]1([C@]2(O[C@](C[C@@H]1O)(C(=O)[O-])O[C@@]2([C@@H](CO)O)[H])[H])NC(C)=O
ChEBI Ontology
Outgoing N-acetyl-2,7-anhydro-α-neuraminate (CHEBI:229228) is a N-acetylneuraminates (CHEBI:21619)
N-acetyl-2,7-anhydro-α-neuraminate (CHEBI:229228) is conjugate base of N-acetyl-2,7-anhydro-α-neuraminic acid (CHEBI:28695)
Incoming N-acetyl-2,7-anhydro-α-neuraminic acid (CHEBI:28695) is conjugate acid of N-acetyl-2,7-anhydro-α-neuraminate (CHEBI:229228)
Synonym Source
N-acetyl-2,7-anhydro-α-neuraminate UniProt
Manual Xref Database
CPD-6182 MetaCyc accession
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