KEGG   COMPOUND: C00301Help
Entry
C00301                      Compound                               

Name
ADP-ribose;
ADP-D-ribose;
Adenosine diphosphate ribose
Formula
C15H23N5O14P2
Exact mass
559.0717
Mol weight
559.3157
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00230  Purine metabolism
map01100  Metabolic pathways
Enzyme
2.7.7.35        2.7.7.96        3.2.2.5         3.2.2.6         
3.2.2.19        3.2.2.24        3.5.1.-         3.6.1.13        
3.6.1.21        3.6.1.53        3.6.1.-
Other DBs
PubChem: 3595
ChEBI: 16960
ChEMBL: CHEMBL1161865 CHEMBL2360089
PDB-CCD: APR[PDBj]
3DMET: B01211
NIKKAJI: J17.074G
KCF data Show

ATOM        36
            1   N4y N    33.2505  -22.7909
            2   C8y C    32.0067  -22.4003
            3   C1y C    31.6209  -24.9096
            4   C8x C    34.0698  -21.7274
            5   C8y C    31.9947  -21.0966
            6   N5x N    30.8650  -23.0674
            7   O2x O    30.5395  -24.1286
            8   C1y C    31.2245  -26.1353
            9   N5x N    33.2325  -20.6880
            10  C8y C    30.8530  -20.4356
            11  C8x C    29.7175  -22.4305
            12  C1y C    29.4821  -24.8855
            13  C1y C    29.8966  -26.1353
            14  O1a O    31.9995  -27.1929
            15  N5x N    29.7815  -21.1026
            16  N1a N    30.8472  -19.1320
            17  C1b C    28.2503  -24.5012
            18  O1a O    29.1457  -27.1929
            19  O2b O    27.1987  -24.4531
            20  P1b P    25.7869  -24.4469
            21  O2c O    24.0204  -24.4531
            22  O1c O    25.7869  -25.9732
            23  O1c O    25.7869  -22.9870
            24  P1b P    22.3860  -24.4469
            25  O2b O    20.9800  -24.4589
            26  O1c O    22.3922  -25.9071
            27  O1c O    22.3860  -22.9809
            28  C1b C    19.6162  -24.4412
            29  C1y C    18.3966  -24.8676
            30  O2x O    17.3088  -24.1466
            31  C1y C    18.0539  -26.2014
            32  C1y C    16.2575  -24.9638
            33  C1y C    16.7022  -26.1616
            34  O1a O    18.8292  -27.2312
            35  O1a O    14.9658  -23.7019
            36  O1a O    15.9631  -27.3274
BOND        39
            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    5   9 1
            37   11  15 1
            38   12  13 1
            39   32  33 1

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