KEGG   COMPOUND: C06128Help
Entry
C06128                      Compound                               

Name
GM4;
N-Acetylneuraminyl-galactosylceramide;
Neu5Ac-alpha2->3Gal-beta1->1'Cer
Formula
C36H63N2O16R
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Comment
Generic compound in reaction hierarchy
Reaction
Pathway
Sphingolipid metabolism
Enzyme
Other DBs
PubChem: 
ChEBI: 
LIPIDMAPS: 
LipidBank: 
KCF data Show

ATOM        55
            1   O2a O    18.1790  -20.3279
            2   C1b C    19.3900  -21.0265
            3   C1c C    20.5542  -20.2813
            4   C1c C    21.7652  -20.9799
            5   N1b N    20.5542  -18.9307
            6   C2b C    22.9760  -20.2813
            7   O1a O    21.8117  -22.4237
            8   C5a C    21.7186  -18.1855
            9   C2b C    24.1869  -20.9799
            10  O5a O    21.7186  -16.8350
            11  R   R    22.9294  -18.8841
            12  C1b C    25.3978  -20.2348
            13  C1b C    26.6087  -20.9334
            14  C1b C    27.8195  -20.2348
            15  C1b C    29.0305  -20.8868
            16  C1b C    30.2413  -20.1882
            17  C1b C    31.4522  -20.8868
            18  C1b C    32.6631  -20.1882
            19  C1b C    33.8740  -20.8402
            20  C1b C    35.0848  -20.1416
            21  C1b C    36.2958  -20.8402
            22  C1b C    37.5066  -20.1416
            23  C1b C    38.7175  -20.7936
            24  C1a C    39.9284  -20.0951
            25  O2a O    15.7107  -24.4263
            26  C1y C    15.7573  -23.0291
            27  C1y C    16.9682  -22.3770
            28  C1y C    14.5464  -22.3305
            29  C1y C    16.9682  -21.0265
            30  O1a O    17.9462  -22.8894
            31  C1y C    14.5464  -20.9334
            32  O1a O    13.3355  -23.3556
            33  O2x O    15.8038  -20.2813
            34  C1b C    13.3821  -20.2348
            35  O1a O    12.2178  -20.9334
            36  C1z C    14.0341  -25.3577
            37  O2x O    12.8698  -24.6591
            38  C1x C    14.0341  -26.7549
            39  C6a C    15.2450  -25.9632
            40  C1y C    11.6589  -25.3577
            41  C1y C    12.8698  -27.4535
            42  O6a O    16.4093  -25.2646
            43  O6a O    15.2450  -27.4069
            44  C1y C    11.6589  -26.7549
            45  O1a O    12.8698  -28.8040
            46  C1c C    10.4481  -24.6125
            47  C1c C    10.4481  -23.2153
            48  C1b C     9.1906  -22.4703
            49  O1a O     9.1906  -21.0265
            50  O1a O     9.1906  -25.3577
            51  O1a O    11.6589  -22.4703
            52  N1b N    10.4481  -27.4535
            53  C5a C    10.4481  -28.8973
            54  C1a C     9.1906  -29.5958
            55  O5a O    11.6589  -29.5958
BOND        56
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     3   5 1 #Down
            5     4   6 1
            6     4   7 1 #Up
            7     5   8 1
            8     6   9 2
            9     8  10 2
            10    8  11 1
            11    9  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 1
            24   26  25 1 #Up
            25   26  27 1
            26   26  28 1
            27   27  29 1
            28   27  30 1 #Down
            29   28  31 1
            30   28  32 1 #Up
            31   29   1 1 #Up
            32   29  33 1
            33   31  34 1 #Up
            34   34  35 1
            35   31  33 1
            36   36  37 1
            37   36  25 1 #Down
            38   36  38 1
            39   36  39 1 #Up
            40   37  40 1
            41   38  41 1
            42   39  42 1
            43   39  43 2
            44   40  44 1
            45   41  45 1 #Down
            46   41  44 1
            47   40  46 1
            48   46  47 1
            49   47  48 1
            50   48  49 1
            51   46  50 1 #Down
            52   47  51 1 #Up
            53   44  52 1 #Up
            54   52  53 1
            55   53  54 1
            56   53  55 2

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