KEGG   COMPOUND: C18156
Entry
C18156                      Compound                               
Name
Bacteriochlorophyllide b
Formula
C35H34MgN4O6
Exact mass
630.2329
Mol weight
630.9727
Structure
Reaction
Pathway
map00860  Porphyrin metabolism
Enzyme
Other DBs
PubChem: 96024373
ChEBI: 81547
LinkDB
KCF data

ATOM        46
            1   C8y C    36.3062  -27.6685
            2   C8y C    35.0674  -28.2050
            3   N4y N    36.4010  -26.3102
            4   C8y C    37.6344  -28.1752
            5   C8y C    33.7922  -27.6930
            6   C8y C    37.7171  -26.0016
            7   C8y C    38.4382  -27.1448
            8   C1y C    32.5897  -28.3000
            9   N5x N    33.5771  -26.3466
            10  C8x C    38.2058  -24.7861
            11  N4y N    33.4825  -23.4339
            12  C1y C    31.6241  -27.4001
            13  C8y C    32.2565  -26.1257
            14  C8y C    37.7054  -23.5649
            15  C8y C    33.6555  -22.0875
            16  C8y C    32.1361  -23.6724
            17  C8x C    31.7073  -24.9289
            18  C2y C    38.3191  -22.3374
            19  N5x N    36.3647  -23.3626
            20  C8y C    32.4283  -21.5169
            21  C8x C    34.8828  -21.4270
            22  C8y C    31.4932  -22.4871
            23  C1y C    37.3549  -21.4027
            24  C8y C    36.1450  -22.0350
            25  C5a C    32.4167  -20.1402
            26  C1a C    30.1293  -22.4871
            27  C1a C    37.4061  -20.0326
            28  C1a C    33.5966  -19.4452
            29  C2b C    39.6643  -22.1115
            30  C1a C    40.5810  -23.2249
            31  C5x C    37.1667  -29.5449
            32  C1b C    32.5347  -29.6477
            33  C1b C    31.3415  -30.2665
            34  C6a C    31.2794  -31.6142
            35  O6a O    30.0861  -32.2403
            36  O6a O    32.4175  -32.3356
            37  C1a C    30.1860  -27.4663
            38  C1a C    39.7498  -27.1381
            39  Z   Mg   34.9004  -24.8765
            40  C1y C    35.6594  -29.5199
            41  O5x O    37.9909  -30.7235
            42  C7a C    34.8718  -30.7233
            43  O6a O    33.4346  -30.6434
            44  O7a O    35.5212  -32.0135
            45  C1a C    34.7264  -33.2166
            46  O5a O    31.2055  -19.4548
BOND        52
            1    14  18 1
            2    14  19 2
            3    15  20 2
            4    15  21 1
            5    16  22 2
            6    18  23 1
            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 1
            18   18  29 2
            19   29  30 1
            20    1   2 2
            21    4  31 1
            22    1   3 1
            23    8  32 1 #Up
            24    1   4 1
            25   32  33 1
            26    2   5 1
            27   33  34 1
            28    3   6 1
            29   34  35 1
            30    4   7 2
            31   34  36 2
            32    5   8 1
            33   12  37 1 #Down
            34    5   9 2
            35    7  38 1
            36    6  10 2
            37   11  39 1
            38    3  39 1
            39    8  12 1
            40    2  40 1
            41   40  31 1
            42    9  13 1
            43   31  41 2
            44   10  14 1
            45   40  42 1 #Down
            46   11  15 1
            47   42  43 2
            48   11  16 1
            49   42  44 1
            50   13  17 2
            51   44  45 1
            52   25  46 2

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