KEGG   COMPOUND: C00857Help
Entry
C00857                      Compound                               

Name
Deamino-NAD+;
Deamido-NAD+;
Deamido-NAD
Formula
C21H27N6O15P2
Exact mass
665.101
Mol weight
665.4178
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Nicotinate and nicotinamide metabolism
Metabolic pathways
Enzyme
2.7.7.1         2.7.7.18        3.6.1.9         3.6.1.22        
6.3.1.5         6.3.5.1
Other DBs
PubChem: 
ChEBI: 
PDB-CCD: 
3DMET: 
KCF data Show

ATOM        44
            1   N4y N    31.3662  -15.7713
            2   C8y C    30.0919  -15.3680
            3   C1y C    31.0214  -18.0103
            4   C8x C    32.1320  -14.6782
            5   C8y C    30.0802  -14.0350
            6   N5x N    28.9169  -16.0519
            7   O2x O    29.9224  -17.2094
            8   C1y C    30.6239  -19.2672
            9   N5x N    31.3488  -13.6200
            10  C8y C    28.9052  -13.3569
            11  C8x C    27.7419  -15.3972
            12  C1y C    28.8350  -17.9869
            13  C1y C    29.2617  -19.2672
            14  O1a O    31.4130  -20.3543
            15  N5x N    27.7359  -14.0409
            16  N1a N    28.8993  -12.0883
            17  C1b C    27.3624  -17.5193
            18  O1a O    28.4842  -20.3543
            19  O2b O    26.2809  -17.4725
            20  P1b P    24.7669  -17.4668
            21  O2c O    22.9606  -17.4725
            22  O1c O    24.7669  -19.0334
            23  O1c O    24.7669  -15.9702
            24  P1b P    21.2829  -17.4668
            25  O2b O    19.8389  -17.4785
            26  O1c O    21.2887  -18.9574
            27  O1c O    21.2829  -15.9644
            28  C1b C    18.5118  -17.5309
            29  C1y C    17.2666  -17.9693
            30  O2x O    16.1501  -17.2269
            31  C1y C    16.9101  -19.3314
            32  C1y C    15.0744  -18.0628
            33  C1y C    15.5245  -19.3665
            34  O1a O    17.7109  -20.3252
            35  N5y N    13.7475  -16.7709 #+
            36  O1a O    14.7705  -20.4188
            37  C8x C    14.7764  -16.0168
            38  C8x C    12.4673  -16.0693
            39  C8y C    14.7822  -14.6665
            40  C8x C    12.4496  -14.8067
            41  C8x C    13.5838  -14.0701
            42  C6a C    15.8987  -13.9299
            43  O6a O    15.8987  -12.7373
            44  O6a O    17.0971  -14.5319
BOND        48
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13    8  14 1 #Down
            14   10  15 2
            15   10  16 1
            16   12  17 1 #Up
            17   13  18 1 #Down
            18   17  19 1
            19   19  20 1
            20   20  21 1
            21   20  22 1
            22   20  23 2
            23   21  24 1
            24   24  25 1
            25   24  26 1
            26   24  27 2
            27   25  28 1
            28   29  28 1 #Down
            29   29  30 1
            30   29  31 1
            31   30  32 1
            32   31  33 1
            33   31  34 1 #Up
            34   32  35 1 #Down
            35   33  36 1 #Up
            36   35  37 1
            37   35  38 2
            38   37  39 2
            39   38  40 1
            40   39  41 1
            41   39  42 1
            42   42  43 1
            43   42  44 2
            44    5   9 1
            45   11  15 1
            46   12  13 1
            47   32  33 1
            48   40  41 2

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