CHEBI:21500 - N-acetyl-9-O-acetylneuraminic acid

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ChEBI Name N-acetyl-9-O-acetylneuraminic acid
ChEBI ID CHEBI:21500
ChEBI ASCII Name N-acetyl-9-O-acetylneuraminic acid
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C13H21NO10
Net Charge 0
Average Mass 351.30658
Monoisotopic Mass 351.11655
InChI InChI=1S/C13H21NO10/c1-5(15)14-9-7(17)3-13(22,12(20)21)24-11(9)10(19)8(18)4-23-6(2)16/h7-11,17-19,22H,3-4H2,1-2H3,(H,14,15)(H,20,21)/t7-,8+,9+,10+,11+,13-/m0/s1
InChIKey NYWZBRWKDRMPAS-GRRZBWEESA-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)COC(C)=O
ChEBI Ontology
Outgoing N-acetyl-9-O-acetylneuraminic acid (CHEBI:21500) is a N-acetyl-O-acetylneuraminic acid (CHEBI:21569)
N-acetyl-9-O-acetylneuraminic acid (CHEBI:21500) is conjugate acid of N-acetyl-9-O-acetylneuraminate (CHEBI:28999)
Incoming N-acetyl-9-O-acetylneuraminate (CHEBI:28999) is conjugate base of N-acetyl-9-O-acetylneuraminic acid (CHEBI:21500)
IUPAC Name
5-acetamido-9-O-acetyl-3,5-dideoxy-D-glycero-β-D-galacto-non-2-ulopyranosonic acid
Synonyms Sources
9-Anana ChemIDplus
9-O-Acetyl-N-acetylneuraminic acid ChemIDplus
9-O-Acetylsialic acid ChemIDplus
Manual Xref Database
C04017 KEGG COMPOUND
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Registry Number Type Source
55717-54-9 CAS Registry Number ChemIDplus
Last Modified
18 January 2007