KEGG   COMPOUND: C20564
Entry
C20564                      Compound                               

Name
Fumitremorgin A
Formula
C32H41N3O7
Exact mass
579.2945
Mol weight
579.6838
Structure
Reaction
Pathway
map00404  Staurosporine biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00786  Fumitremorgin alkaloid biosynthesis, tryptophan + proline => fumitremorgin C/A
Enzyme
Other DBs
CAS: 12626-18-5
PubChem: 172232301
KCF data

ATOM        42
            1   C8y C    18.1404  -17.7295
            2   C8y C    18.1404  -16.3240
            3   C1y C    19.3351  -15.6213
            4   C1z C    20.6001  -16.3240
            5   N1y N    20.6001  -17.7295
            6   C1y C    19.3351  -18.4323
            7   C5x C    21.7245  -15.6213
            8   N1y N    22.9191  -16.3240
            9   C1y C    22.9191  -17.7295
            10  C5x C    21.7245  -18.4323
            11  C1x C    24.2544  -15.9024
            12  C1x C    25.0977  -17.0268
            13  C1x C    24.2544  -18.1512
            14  N4y N    16.8052  -18.1512
            15  C8y C    15.9619  -17.0268
            16  C8y C    16.8052  -15.9024
            17  C8x C    14.5563  -16.8863
            18  C8y C    13.9941  -15.6213
            19  C8x C    14.8374  -14.4266
            20  C8x C    16.2429  -14.6374
            21  O2x O    17.6484  -21.3839
            22  C1z C    19.0539  -21.0325
            23  C1x C    19.7567  -19.8378
            24  C1y C    16.1024  -19.3459
            25  O2x O    16.4537  -20.6812
            26  O5x O    21.7245  -19.8378
            27  O2a O    19.2649  -14.2157
            28  O1a O    20.6001  -14.9185
            29  O5x O    21.7245  -14.2157
            30  C1a C    20.4595  -21.0325
            31  C1a C    19.7567  -22.2272
            32  C1b C    18.0702  -13.5833
            33  C2b C    18.0702  -12.1778
            34  C2c C    16.8052  -11.4750
            35  C1a C    15.6808  -12.1778
            36  C1a C    16.8055  -10.0695
            37  O2a O    12.7994  -15.2699
            38  C1a C    12.1670  -13.8644
            39  C2b C    14.6969  -19.1350
            40  C2c C    13.8535  -20.2595
            41  C1a C    12.4480  -20.0486
            42  C1a C    14.3455  -21.5244
BOND        47
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    8  11 1
            13   11  12 1
            14   12  13 1
            15    9  13 1
            16    1  14 1
            17   14  15 1
            18   15  16 1
            19    2  16 1
            20   15  17 2
            21   17  18 1
            22   18  19 2
            23   19  20 1
            24   16  20 2
            25   21  22 1
            26   22  23 1
            27   14  24 1
            28   24  25 1
            29   25  21 1
            30   10  26 2
            31    3  27 1 #Down
            32    4  28 1 #Down
            33    7  29 2
            34   22  30 1
            35   22  31 1
            36   27  32 1
            37   32  33 1
            38   33  34 2
            39   34  35 1
            40   34  36 1
            41   18  37 1
            42   37  38 1
            43   39  40 2
            44   40  41 1
            45   40  42 1
            46   24  39 1 #Down
            47   23   6 1

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