CHEBI:49022 - β-neuraminic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name β-neuraminic acid
ChEBI ID CHEBI:49022
ChEBI ASCII Name beta-neuraminic acid
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H17NO8
Net Charge 0
Average Mass 267.23322
Monoisotopic Mass 267.09542
InChI InChI=1S/C9H17NO8/c10-5-3(12)1-9(17,8(15)16)18-7(5)6(14)4(13)2-11/h3-7,11-14,17H,1-2,10H2,(H,15,16)/t3-,4+,5+,6+,7+,9-/m0/s1
InChIKey CERZMXAJYMMUDR-YOQZMRDMSA-N
SMILES [H][C@]1(O[C@@](O)(C[C@H](O)[C@H]1N)C(O)=O)[C@H](O)[C@H](O)CO
ChEBI Ontology
Outgoing β-neuraminic acid (CHEBI:49022) is a 5-amino-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid (CHEBI:7539)
Incoming N,N-diacetyllegionaminic acid (CHEBI:68682) has functional parent β-neuraminic acid (CHEBI:49022)
N-acetyl-β-neuraminic acid (CHEBI:45744) has functional parent β-neuraminic acid (CHEBI:49022)
legionaminic acid (CHEBI:68676) has functional parent β-neuraminic acid (CHEBI:49022)
IUPAC Name
5-amino-3,5-dideoxy-D-glycero-β-D-galacto-non-2-ulopyranosonic acid
Registry Number Type Source
2508435 Beilstein Registry Number Beilstein
Last Modified
23 October 2015