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CHEBI:68676 - legionaminic acid

ChEBI IDCHEBI:68676
ChEBI Namelegionaminic acid
Stars
DefinitionA ketoaldonic acid derivative that is β-neuraminic acid in which the hydroxy groups at positions 7 and 9 are substituted by an amino group and hydrogen respectively.
Last Modified11 October 2012
SubmitterSteve
DownloadsMolfile
FormulaC9H18N2O6
Net Charge0
Average Mass250.251
Monoisotopic Mass250.11649
SMILES[H][C@@]1([C@H](N)[C@@H](C)O)O[C@](O)(C(=O)O)C[C@H](O)[C@H]1N
InChIInChI=1S/C9H18N2O6/c1-3(12)5(10)7-6(11)4(13)2-9(16,17-7)8(14)15/h3-7,12-13,16H,2,10-11H2,1H3,(H,14,15)/t3-,4+,5-,6-,7+,9+/m1/s1
InChIKeyZFZFJUIKYIVPNP-OWTNSLFHSA-N
ChEBI Ontology
Outgoing Relation(s)
legionaminic acid (CHEBI:68676) has functional parent β-neuraminic acid (CHEBI:49022)
legionaminic acid (CHEBI:68676) is a amino sugar (CHEBI:28963)
legionaminic acid (CHEBI:68676) is a ketoaldonic acid derivative (CHEBI:63394)
legionaminic acid (CHEBI:68676) is conjugate base of legionaminate(1+) (CHEBI:68668)
Incoming Relation(s)
CMP-N,N-diacetyllegionaminic acid (CHEBI:68683) has functional parent legionaminic acid (CHEBI:68676)
legionaminate(1+) (CHEBI:68668) is conjugate acid of legionaminic acid (CHEBI:68676)
IUPAC Name 
5,7-diamino-3,5,7,9-tetradeoxy-D-glycero-β-D-galacto-non-2-ulopyranosonic acid
Synonym  Source
(6S)-5-amino-6-[(1R,2R)-1-amino-2-hydroxypropyl]-3,5-dideoxy-α-L-threo-hex-2-ulopyranosonateIUPAC