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N-glycoloylneuraminate

PropertiesImage
MNX_IDMNXM1106131 Image of MNXM1106131
referencechebi:29025
formulaC11H18NO10
global charge-1
mol weight324.262
InChIKeyFDJKUWYYUZCUJX-PGIATKPXSA-M
InChIInChI=1S/C11H19NO10/c13-2-5(16)8(18)9-7(12-6(17)3-14)4(15)1-11(21,22-9)10(19)20/h4-5,7-9,13-16,18,21H,1-3H2,(H,12,17)(H,19,20)/p-1/t4-,5+,7+,8+,9+,11?/m0/s1
SMILESO=C(CO)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)OC(O)(C(=O)[O-])C[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C11H19NO10/c13-2-5(16)8(18)9-7(12-6(17)3-14)4(15)1-11(21,22-9)10(19)20/h4-5,7-9,13-16,18,21H,1-3H2,(H,12,17)(H,19,20)/t4-,5+,7+,8+,9+,11?/m0/s1 Image of MNXM1106131
SMILES (mnx)[CH2:1]1[C@H:4]([OH:15])[C@@H:7]([N:12]=[C:6]([CH2:3][OH:14])[OH:17])[C@H:9]([C@@H:8]([C@@H:5]([CH2:2][OH:13])[OH:16])[OH:18])[O:22][C:11]1([C:10](=[O:19])[OH:20])[OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)16
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-4088097
reactomeM:R-ALL-4088097
CHEBI:29025
chebi:29025
FDJKUWYYUZCUJX-PGIATKPXSA-M 		N-glycoloylneuraminate
3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-D-galacto-non-2-ulopyranosonate
N-Glycoloyl-neuraminate
N-Glycolylneuraminate
NeuNGc

sabiork.compound:6609
sabiorkM:6609
FDJKUWYYUZCUJX-PGIATKPXSA-M 		N-Glycoloyl-neuraminate
GcNeu
N-Glycolylneuraminate
NeuNGc

kegg.compound:C03410
keggC:C03410
FDJKUWYYUZCUJX-PGIATKPXSA-N 		N-Glycoloyl-neuraminate
N-Glycolylneuraminate
Neu5Gc

CHEBI:146193
chebi:146193
FDJKUWYYUZCUJX-PGIATKPXSA-N 		N-glycoloylneuraminic acid

metacyc.compound:CPD-273
metacycM:CPD-273
FDJKUWYYUZCUJX-PGIATKPXSA-M 		N-glycolylneuraminate
N--glycolylneuraminic acid
N-glycoloyl-neuraminate
Neu5Gc

bigg.metabolite:HC01115
biggM:HC01115
FDJKUWYYUZCUJX-PGIATKPXSA-M 		NeuNGc

vmhM:HC01115
vmhmetabolite:HC01115
FDJKUWYYUZCUJX-PGIATKPXSA-M 		NeuNGc
(2S,4S,5R,6R)-2,4-dihydroxy-5-(2-hydroxyacetamido)-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
hmdb:HMDB0062502
FDJKUWYYUZCUJX-PGIATKPXSA-N 		NeuNGc
(4S,5R,6R)-2,4-dihydroxy-5-(2-hydroxyacetamido)-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
GcNeu
N-Glycoloyl-neuraminic acid
N-Glycoloylneuraminic acid
N-Glycolylneuraminate
N-Glycolylneuraminic acid
N-Glycolylneuraminic acid, (alpha-D-gal)-isomer
NGNA
Neu5GC

seed.compound:cpd02155
seedM:cpd02155
FDJKUWYYUZCUJX-PGIATKPXSA-M 		NeuNGc
N--glycolylneuraminic acid
N-Glycoloyl-neuraminate
N-Glycolylneuraminate
N-glycoloyl-neuraminate
N-glycolylneuraminate
Neu5Gc

hmdb:HMDB62502
chebi:21729
chebi:7286
biggM:M_HC01115
keggC:M_C03410
seedM:M_cpd02155
vmhM:M_HC01115 		secondary/obsolete/fantasy identifier