KEGG   COMPOUND: C04872Help
Entry
C04872                      Compound                               

Name
1,2-Diacyl-3-[3-(alpha-D-N-acetylneuraminyl)-beta-D-galactosyl]-sn-glycerol
Formula
C22H33NO18R2
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Glycerolipid metabolism
Enzyme
Brite
Lipids [BR:br08002]
 GL  Glycerolipids
  GL05 Glycosyldiradylglycerols
   GL0501 Glycosyldiacylglycerols
    C04872  1,2-Diacyl-3-[3-(alpha-D-N-acetylneuraminyl)-beta-D-galactosyl]-sn-glycerol
BRITE hierarchy
Other DBs
PubChem: 
ChEBI: 
LIPIDMAPS: 
KCF data Show

ATOM        43
            1   C1z C    15.5400  -17.8500
            2   O2x O    14.4200  -17.1500
            3   O2a O    17.0100  -16.7300
            4   C1x C    15.5400  -19.1800
            5   C6a C    16.7300  -18.4100
            6   C1y C    13.1600  -17.8500
            7   C1y C    17.0100  -15.3300
            8   C1y C    14.4200  -19.8800
            9   O6a O    17.9200  -17.7100
            10  O6a O    16.7300  -19.8800
            11  C1y C    13.1600  -19.1800
            12  C1y C    15.8200  -14.6300
            13  C1y C    18.2000  -14.6300
            14  O1a O    14.4200  -21.2800
            15  C1y C    15.8200  -13.3000
            16  O1a O    14.6300  -15.3300
            17  C1y C    18.2000  -13.3000
            18  O2x O    17.0100  -12.6000
            19  C1b C    14.6300  -12.6000
            20  O2a O    19.3900  -12.6000
            21  C1c C    11.9700  -17.0800
            22  C1c C    11.9700  -15.6800
            23  C1b C    10.7100  -14.9100
            24  O1a O    10.7100  -13.4400
            25  O1a O    10.7100  -17.8500
            26  O1a O    13.1600  -14.9100
            27  N1b N    11.9700  -19.8800
            28  C5a C    11.9700  -21.3500
            29  C1a C    10.7100  -22.0500
            30  O5a O    13.1600  -22.0500
            31  O1a O    19.4600  -15.3300
            32  O1a O    13.4400  -13.3000
            33  C1b C    20.6500  -13.3000
            34  C1c C    21.8400  -12.6000
            35  C1b C    23.1000  -13.3000
            36  O7a O    24.2200  -12.6000
            37  C7a C    25.4800  -13.3000
            38  O7a O    21.8400  -11.2000
            39  C7a C    23.0300  -10.5000
            40  R   R    24.2900  -11.2000
            41  O6a O    23.0300   -9.1000
            42  O6a O    26.6700  -12.6000
            43  R   R    25.4800  -14.7000
BOND        44
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 1
            6     7   3 1 #Up
            7     4   8 1
            8     5   9 1
            9     5  10 2
            10    6  11 1
            11    7  12 1
            12    7  13 1
            13    8  14 1 #Down
            14   12  15 1
            15   12  16 1 #Up
            16   13  17 1
            17   15  18 1
            18   15  19 1 #Up
            19   17  20 1 #Up
            20    8  11 1
            21   17  18 1
            22    6  21 1
            23   21  22 1
            24   22  23 1
            25   23  24 1
            26   21  25 1 #Down
            27   22  26 1 #Up
            28   11  27 1 #Up
            29   27  28 1
            30   28  29 1
            31   28  30 2
            32   13  31 1 #Down
            33   19  32 1
            34   20  33 1
            35   33  34 1
            36   34  35 1
            37   35  36 1
            38   36  37 1
            39   34  38 1 #Down
            40   38  39 1
            41   39  40 1
            42   39  41 2
            43   37  42 2
            44   37  43 1

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