KEGG   COMPOUND: C22171
Entry
C22171                      Compound                               
Name
Roquefortine F
Formula
C23H25N5O3
Exact mass
419.1957
Mol weight
419.4763
Structure
Reaction
R12447 R12448
Pathway
map00404  Staurosporine biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.14.-       2.1.1.-
Other DBs
PubChem: 405226362
LinkDB
KCF data

ATOM        31
            1   C8y C    15.7717  -16.0521
            2   C1z C    17.1035  -15.6315
            3   C8y C    15.7717  -17.4540
            4   C8x C    14.5800  -15.2810
            5   C1x C    17.8746  -14.5099
            6   N1y N    17.0334  -17.9447
            7   C8x C    14.5099  -18.1549
            8   C8x C    13.3183  -15.9820
            9   C8x C    13.3183  -17.5241
            10  C1y C    17.8045  -16.8231
            11  C1y C    19.2064  -14.8604
            12  N1y N    19.2064  -16.2623
            13  C5x C    20.4681  -16.9633
            14  C2y C    21.6598  -16.1922
            15  N1x N    21.6598  -14.7903
            16  C5x C    20.3980  -14.1595
            17  O5x O    20.3980  -12.7575
            18  O5x O    20.4681  -18.3652
            19  C8y C    22.8514  -18.2250
            20  C2b C    22.8514  -16.8932
            21  N5x N    21.7999  -19.0662
            22  C8x C    22.2205  -20.3980
            23  N4x N    23.6225  -20.3279
            24  C8x C    23.9729  -18.9961
            25  C1d C    16.4025  -14.4398
            26  C1a C    17.3138  -13.3183
            27  C1a C    15.0006  -14.4398
            28  C2b C    15.7016  -13.2482
            29  C2a C    16.4025  -12.0566
            30  O2a O    17.0334  -19.3466
            31  C1a C    15.8210  -20.0466
BOND        35
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     3   7 1
            7     4   8 2
            8     7   9 2
            9     8   9 1
            10    2  10 1
            11   10   6 1
            12    5  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   11  16 1
            19   16  17 2
            20   13  18 2
            21   19  20 1
            22   14  20 2
            23   19  21 1
            24   21  22 2
            25   22  23 1
            26   23  24 1
            27   19  24 2
            28   10  12 1
            29    2  25 1
            30   25  26 1
            31   25  27 1
            32   25  28 1
            33   28  29 2
            34    6  30 1
            35   30  31 1

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