N-acetyl-2,7-anhydro-alpha-neuraminate (CHEBI:229228)

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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

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