KEGG   COMPOUND: C11830Help
Entry
C11830                      Compound                               

Name
13(1)-Oxo-magnesium-protoporphyrin IX 13-monomethyl ester;
13(1)-Oxo-Mg-protoporphyrin IX 13-monomethyl ester
Formula
C35H32MgN4O5
Exact mass
612.2223
Mol weight
612.9574
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00860  Porphyrin and chlorophyll metabolism
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.13.81      1.21.98.3
Other DBs
PubChem: 13994
ChEBI: 15433
3DMET: B04326
KCF data Show

ATOM        45
            1   C8y C    28.1672  -23.0901
            2   C8x C    26.9262  -23.6275
            3   N4y N    28.2692  -21.7296
            4   C8y C    29.4974  -23.5976
            5   C8y C    25.6490  -23.1147
            6   C8y C    29.5804  -21.4135
            7   C8y C    30.3026  -22.5585
            8   C8y C    24.4445  -23.7157
            9   N5x N    25.4335  -21.7660
            10  C8x C    30.0697  -20.1958
            11  N4y N    25.3387  -18.8414
            12  C8y C    23.4773  -22.8141
            13  C8y C    24.1106  -21.5447
            14  C8y C    29.5686  -18.9796
            15  C8y C    25.5121  -17.4998
            16  C8y C    23.9900  -19.0804
            17  C8x C    23.5605  -20.3459
            18  C8y C    30.1834  -17.7503
            19  N5x N    28.2257  -18.7700
            20  C8y C    24.2898  -16.9214
            21  C8x C    26.7413  -16.8383
            22  C8y C    23.3461  -17.8932
            23  C8y C    29.2174  -16.8138
            24  C8y C    28.0056  -17.4401
            25  C2b C    24.2711  -15.5423
            26  C1a C    21.9871  -17.8932
            27  C1a C    29.2057  -15.4416
            28  C2a C    25.4602  -14.8462
            29  C2b C    31.5378  -17.5239
            30  C2a C    32.4560  -18.6320
            31  C5a C    29.4672  -25.0403
            32  O5a O    30.6995  -25.7866
            33  C1b C    24.3893  -25.0654
            34  C1b C    23.1942  -25.6925
            35  C6a C    23.1389  -27.0352
            36  O6a O    21.9367  -27.6623
            37  O6a O    24.2718  -27.7650
            38  C1a C    22.0368  -22.8876
            39  C1a C    31.6164  -22.6291
            40  Z   Mg   26.7588  -20.2937
            41  C1b C    28.1983  -25.7352
            42  C7a C    28.1684  -27.1767
            43  O6a O    26.9066  -27.8717
            44  O7a O    29.4006  -27.9232
            45  C1a C    30.6695  -27.2284
BOND        50
            1    14  18 1
            2    14  19 2
            3    15  20 2
            4    15  21 1
            5    16  22 2
            6    18  23 2
            7    19  24 1
            8    20  25 1
            9    22  26 1
            10   23  27 1
            11    6   7 1
            12   12  13 1
            13   16  17 1
            14   20  22 1
            15   21  24 2
            16   23  24 1
            17   25  28 2
            18   18  29 1
            19   29  30 2
            20    1   2 2
            21    4  31 1
            22    1   3 1
            23   31  32 2
            24    1   4 1
            25    8  33 1
            26    2   5 1
            27   33  34 1
            28    3   6 1
            29   34  35 1
            30    4   7 2
            31   35  36 1
            32    5   8 1
            33   35  37 2
            34    5   9 2
            35   12  38 1
            36    6  10 2
            37    7  39 1
            38    8  12 2
            39   11  40 1
            40    3  40 1
            41    9  13 1
            42   31  41 1
            43   10  14 1
            44   41  42 1
            45   11  15 1
            46   42  43 2
            47   11  16 1
            48   42  44 1
            49   13  17 2
            50   44  45 1

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