KEGG   COMPOUND: C00081Help
Entry
C00081                      Compound                               

Name
ITP;
Inosine 5'-triphosphate;
Inosine triphosphate;
Inosine tripolyphosphate
Formula
C10H15N4O14P3
Exact mass
507.9798
Mol weight
508.1658
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Purine metabolism
Enzyme
2.7.1.1         2.7.1.11        2.7.1.40        2.7.1.48        
2.7.4.6         3.5.4.18        3.6.1.5         3.6.1.8         
3.6.1.14        3.6.1.19        4.1.1.32        6.2.1.4
Other DBs
CAS: 
132-06-9
PubChem: 
ChEBI: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        31
            1   N4y N    28.6360  -15.8923
            2   C8y C    27.3157  -15.4691
            3   C1y C    27.5998  -17.9139
            4   C8x C    29.4444  -14.7869
            5   C8y C    27.3157  -14.0794
            6   N5x N    26.1153  -16.1766
            7   O2x O    26.4691  -17.0800
            8   C1y C    27.1830  -19.1963
            9   N5x N    28.6422  -13.6560
            10  C8y C    26.1153  -13.3971
            11  C8x C    24.9214  -15.4691
            12  C1y C    25.3510  -17.8822
            13  C1y C    25.7869  -19.1963
            14  O1a O    27.9979  -20.3082
            15  N4x N    24.9214  -14.0794
            16  O5x O    26.1091  -12.1599
            17  C1b C    24.0560  -17.4779
            18  O1a O    25.0035  -20.3208
            19  O2b O    23.0325  -18.0845
            20  P1b P    21.6554  -18.0845
            21  O2c O    20.2783  -18.0845
            22  O1c O    21.6554  -16.5674
            23  O1c O    21.6491  -19.4554
            24  P1b P    18.9074  -18.0845
            25  O2c O    17.5303  -18.0845
            26  O1c O    18.9074  -16.5674
            27  O1c O    18.9074  -19.4554
            28  P1b P    16.1594  -18.0845
            29  O1c O    14.7823  -18.0845
            30  O1c O    16.1594  -16.5674
            31  O1c O    16.1594  -19.4554
BOND        33
            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 1
            15   10  16 2
            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   28  29 1
            29   28  30 1
            30   28  31 2
            31    5   9 1
            32   11  15 1
            33   12  13 1

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