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N,N-diacetyllegionaminate

Properties Image Occurences in reactions MNX_ID MNXM1367880 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 2 formula C13H21N2O8 charge -1 mass 333.317 reference chebi:68669 InChIKey ZJOSXOOPEBJBMC-DAJNMGJPSA-M InChI InChI=1S/C13H22N2O8/c1-5(16)9(14-6(2)17)11-10(15-7(3)18)8(19)4-13(22,23-11)12(20)21/h5,8-11,16,19,22H,4H2,1-3H3,(H,14,17)(H,15,18)(H,20,21)/p-1/t5-,8+,9-,10-,11+,13+/m1/s1 SMILES [CH3:1][C@H:5]([C@H:9]([C@H:11]1[C@H:10]([N:15]=[C:7]([CH3:3])[OH:18])[C@@H:8]([OH:19])[CH2:4][C@:13]([C:12](=[O:20])[OH:21])([OH:22])[O:23]1)[N:14]=[C:6]([CH3:2])[OH:17])[OH:16]

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Similar chemical compounds in external resources

Identifier	Description
CHEBI:68669 chebi:68669	N,N-diacetyllegionaminate (6S)-5-acetamido-6-[(1R,2R)-1-acetamido-2-hydroxypropyl]-3,5-dideoxy-alpha-L-threo-hex-2-ulopyranosonate 5,7-diacetamido-3,5,7,9-tetradeoxy-D-glycero-D-galacto-non-2-ulosonate 5,7-diacetamido-3,5,7,9-tetradeoxy-D-glycero-beta-D-galacto-non-2-ulopyranosonate N,N-diacetyllegionaminate anion N,N-diacetyllegionaminate(1-)
seed.compound:cpd23763 seedM:cpd23763	5,7-diacetamido-3,5,7,9-tetradeoxy-D-glycero-D-galacto-nonulopyranosonic acid 5,7-diacetamido-3,5,7,9-tetradeoxy-D-glycero-D-galacto-nonulopyranosonate Leg5Ac7Ac N, N'-diacetyllegionaminate N, N'-diacetyllegionaminic acid N,N'-Diacetyllegionaminate legionaminate legionaminic acid
kegg.compound:C20418 keggC:C20418	N,N'-Diacetyllegionaminate
CHEBI:68682 chebi:68682	N,N-diacetyllegionaminic acid (6S)-5-acetamido-6-[(1R,2R)-1-acetamido-2-hydroxypropyl]-3,5-dideoxy-alpha-L-threo-hex-2-ulopyranosonic acid 5,7-diacetamido-3,5,7,9-tetradeoxy-D-glycero-beta-D-galacto-non-2-ulopyranosonic acid
keggC:M_C20418 seedM:M_cpd23763	secondary/obsolete/fantasy identifier