KEGG   COMPOUND: C00270Help
Entry
C00270                      Compound                               

Name
N-Acetylneuraminate;
N-Acetylneuraminic acid;
5-Acetamido-3,5-dideoxy-D-glycero-D-galacto-2-nonulosonic acid;
Neu5Ac
Formula
C11H19NO9
Exact mass
309.106
Mol weight
309.2699
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Amino sugar and nucleotide sugar metabolism
Metabolic pathways
Biosynthesis of secondary metabolites
Enzyme
1.14.18.2       2.3.1.44        2.3.1.45        2.5.1.56        
2.7.7.43        3.1.1.53        3.1.3.29        3.2.1.18        
4.1.3.3
Brite
Compounds with biological roles [BR:br08001]
 Carbohydrates
  Monosaccharides
   Amino sugars
    C00270  N-Acetylneuraminic acid (Neu5Ac)
BRITE hierarchy
Other DBs
CAS: 
131-48-6
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        21
            1   C1y C    24.2148  -21.4379
            2   C1y C    24.2148  -22.8420
            3   O2x O    25.4324  -20.7447
            4   C1c C    22.9971  -20.7447
            5   C1y C    25.4324  -23.5469
            6   N1b N    22.9971  -23.5469
            7   C1z C    26.6383  -21.4379
            8   C1c C    23.0029  -19.3405
            9   O1a O    21.7852  -21.4379
            10  C1x C    26.6383  -22.8420
            11  O1a O    25.4324  -24.9450
            12  C5a C    23.0029  -24.9391
            13  C6a C    27.6287  -20.4418
            14  O1a O    27.9840  -21.7991
            15  C1b C    21.7852  -18.6357
            16  O1a O    24.2148  -18.6357
            17  C1a C    21.7969  -25.6382
            18  O5a O    24.2088  -25.6325
            19  O6a O    28.9861  -20.7971
            20  O6a O    27.2499  -19.0902
            21  O1a O    21.7852  -17.2374
BOND        21
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     4   8 1
            8     4   9 1 #Down
            9     5  10 1
            10    5  11 1 #Down
            11    6  12 1
            12    7  13 1 #Either
            13    7  14 1
            14    8  15 1
            15    8  16 1 #Up
            16   12  17 1
            17   12  18 2
            18   13  19 1
            19   13  20 2
            20   15  21 1
            21    7  10 1

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