KEGG   COMPOUND: C21803
Entry
C21803                      Compound                               

Name
8-Demethyl-8-formylriboflavin 5'-phosphate
Formula
C17H19N4O10P
Exact mass
470.0839
Mol weight
470.3273
Structure
Reaction
Pathway
map00997  Biosynthesis of various secondary metabolites - part 3
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00890  Roseoflavin biosynthesis, FMN => roseoflavin
Enzyme
KCF data

ATOM        32
            1   N4x N    13.1318  -14.0085
            2   C8y C    13.1318  -15.3857
            3   N5x N    14.3024  -16.0743
            4   C8y C    15.5419  -15.3857
            5   C8y C    15.5419  -14.0085
            6   C8y C    14.3024  -13.3199
            7   N4y N    16.7124  -16.0743
            8   C8y C    17.8830  -15.3857
            9   C8y C    17.8830  -14.0085
            10  N5x N    16.7124  -13.3199
            11  C8x C    19.1225  -16.0743
            12  C8y C    20.2931  -15.3857
            13  C8y C    20.2931  -14.0085
            14  C8x C    19.1225  -13.3199
            15  O5x O    14.3024  -11.9427
            16  O5x O    11.9611  -16.0743
            17  C1a C    21.4638  -13.3199
            18  C4a C    21.4638  -16.0743
            19  C1b C    16.7124  -18.3467
            20  C1c C    17.8830  -19.0353
            21  C1c C    19.0537  -18.3467
            22  C1c C    20.2243  -19.0353
            23  C1b C    21.3948  -18.3467
            24  O2b O    22.5655  -19.0353
            25  O1a O    17.8830  -20.4124
            26  O1a O    20.2243  -20.4124
            27  O1a O    19.0537  -16.9694
            28  P1b P    23.9427  -19.0353
            29  O1c O    25.3198  -19.0353
            30  O1c O    23.9427  -17.6581
            31  O1c O    23.9427  -20.4124
            32  O4a O    22.6762  -15.3743
BOND        34
            1     1   2 1
            2     2   3 1
            3     3   4 2
            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 2
            12    8  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16    9  14 2
            17    6  15 2
            18    2  16 2
            19   13  17 1
            20   12  18 1
            21    7  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   20  25 1 #Up
            28   22  26 1 #Up
            29   21  27 1 #Down
            30   24  28 1
            31   28  29 1
            32   28  30 2
            33   28  31 1
            34   18  32 2

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