KEGG   COMPOUND: C05767Help
Entry
C05767                      Compound                               

Name
Uroporphyrin I
Formula
C40H38N4O16
Exact mass
830.2283
Mol weight
830.7469
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Porphyrin and chlorophyll metabolism
Other DBs
CAS: 
607-14-7
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        60
            1   C8y C    22.6708  -13.7890
            2   C8y C    21.6733  -14.7673
            3   C8y C    23.9128  -14.4456
            4   C1b C    22.6966  -12.3927
            5   C8y C    22.2975  -16.0286
            6   C1b C    20.2704  -14.7545
            7   C8x C    25.1871  -13.9628
            8   N4x N    23.6812  -15.8227
            9   C1b C    21.4866  -11.6719
            10  C8x C    21.6348  -17.3221
            11  C6a C    19.5754  -13.5382
            12  C8y C    26.4291  -14.4840
            13  C6a C    21.5189  -10.2754
            14  C8y C    22.2975  -18.5964
            15  O6a O    18.1725  -13.5382
            16  O6a O    20.2833  -12.3283
            17  C8y C    27.6391  -13.7698
            18  N5x N    26.7251  -15.8548
            19  O6a O    20.3219   -9.5481
            20  O6a O    22.7481   -9.5996
            21  C8y C    21.6669  -19.8513
            22  N5x N    23.6877  -18.8088
            23  C8y C    28.6752  -14.7030
            24  C1b C    27.6327  -12.3669
            25  C8y C    28.1153  -15.9899
            26  C8y C    22.6645  -20.8296
            27  C1b C    20.2704  -19.8707
            28  C8y C    23.9128  -20.1925
            29  C1b C    30.0716  -14.6964
            30  C6a C    28.8424  -11.6654
            31  C8x C    28.6429  -17.2837
            32  C1b C    22.6516  -22.2260
            33  C1b C    19.5946  -21.0998
            34  C8x C    25.1871  -20.6622
            35  C1b C    30.7731  -13.4802
            36  O6a O    28.8361  -10.2560
            37  O6a O    30.0523  -12.3669
            38  C8y C    28.0830  -18.5772
            39  C6a C    21.4288  -22.9210
            40  C6a C    18.1917  -21.0427
            41  C8y C    26.4420  -20.1344
            42  C6a C    32.1697  -13.4802
            43  C8y C    28.6816  -19.8449
            44  N4x N    26.6930  -18.7573
            45  O6a O    21.4224  -24.3304
            46  O6a O    20.2254  -22.2002
            47  O6a O    17.5161  -22.3419
            48  O6a O    17.4838  -19.9091
            49  C8y C    27.6712  -20.8038
            50  O6a O    32.8647  -12.2574
            51  O6a O    32.8647  -14.6901
            52  C1b C    30.0844  -19.8007
            53  C1b C    27.6665  -22.1939
            54  C6a C    30.7668  -21.0933
            55  C1b C    29.0871  -22.7730
            56  O6a O    32.1760  -21.0362
            57  O6a O    30.0395  -22.2969
            58  C6a C    29.1457  -24.1695
            59  O6a O    30.4963  -24.7423
            60  O6a O    28.0702  -24.9675
BOND        64
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    6  11 1
            11    7  12 2
            12    9  13 1
            13   10  14 2
            14   11  15 1
            15   11  16 2
            16   12  17 1
            17   12  18 1
            18   13  19 1
            19   13  20 2
            20   14  21 1
            21   14  22 1
            22   17  23 2
            23   17  24 1
            24   18  25 2
            25   21  26 2
            26   21  27 1
            27   22  28 2
            28   23  29 1
            29   24  30 1
            30   25  31 1
            31   26  32 1
            32   27  33 1
            33   28  34 1
            34   29  35 1
            35   30  36 1
            36   30  37 2
            37   31  38 2
            38   32  39 1
            39   33  40 1
            40   34  41 2
            41   35  42 1
            42   38  43 1
            43   38  44 1
            44   39  45 1
            45   39  46 2
            46   40  47 1
            47   40  48 2
            48   41  49 1
            49   42  50 1
            50   42  51 2
            51   43  52 1
            52   49  53 1
            53   52  54 1
            54   53  55 1
            55   54  56 1
            56   54  57 2
            57   55  58 1
            58   58  59 1
            59   58  60 2
            60    5   8 1
            61   23  25 1
            62   26  28 1
            63   41  44 1
            64   43  49 2

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