KEGG   COMPOUND: C06469
Entry
C06469                      Compound                               
Name
Neuraminic acid;
5-Amino-3,5-dideoxy-D-glycero-D-galacto-2-nonulosonic acid
Formula
C9H17NO8
Exact mass
267.0954
Mol weight
267.2332
Structure
Brite
Compounds with biological roles [BR:br08001]
 Carbohydrates
  Monosaccharides
   Amino sugars
    C06469  Neuraminic acid
Other DBs
CAS: 114-04-5
PubChem: 8701
ChEBI: 7539
3DMET: B05202
NIKKAJI: J247.825K J79.635B
LinkDB
KCF data

ATOM        18
            1   C1y C    24.5015  -16.1750
            2   O2x O    25.7180  -15.4824
            3   C1y C    24.5015  -17.5778
            4   C1c C    23.2909  -15.4767
            5   C1z C    26.9286  -16.1750
            6   C1y C    25.7180  -18.2763
            7   N1a N    23.2909  -18.2820
            8   C1c C    23.2909  -14.0797
            9   O1a O    22.0744  -16.1750
            10  C1x C    26.9286  -17.5778
            11  C6a C    27.9124  -15.1798
            12  O1a O    28.2732  -16.5359
            13  O1a O    25.7180  -19.6790
            14  C1b C    22.0744  -13.3753
            15  O1a O    24.5015  -13.3753
            16  O6a O    29.2685  -15.5347
            17  O6a O    27.5341  -13.8294
            18  O1a O    22.0802  -11.9784
BOND        18
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     3   6 1
            6     3   7 1 #Up
            7     4   8 1
            8     4   9 1 #Down
            9     5  10 1
            10    5  11 1 #Either
            11    5  12 1
            12    6  13 1 #Down
            13    8  14 1
            14    8  15 1 #Up
            15   11  16 1
            16   11  17 2
            17   14  18 1
            18    6  10 1

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