KEGG   COMPOUND: C21804Help
Entry
C21804                      Compound                               

Name
8-Carboxy-8-demethylriboflavin 5'-phosphate;
8-Demethyl-8-carboxyriboflavin 5'-phosphate
Formula
C17H19N4O11P
Exact mass
486.0788
Mol weight
486.3267
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00997  Biosynthesis of various secondary metabolites - part 3
Enzyme
KCF data Show

ATOM        33
            1   N4x N    13.1621  -13.9978
            2   C8y C    13.1621  -15.3905
            3   N5x N    14.2763  -16.0869
            4   C8y C    15.5298  -15.3905
            5   C8y C    15.5298  -13.9978
            6   C8y C    14.2763  -13.3014
            7   N4y N    16.7137  -16.0869
            8   C8y C    17.8279  -15.3905
            9   C8y C    17.8279  -13.9978
            10  N5x N    16.7137  -13.3014
            11  C8x C    19.0814  -16.0869
            12  C8y C    20.2653  -15.3905
            13  C8y C    20.2653  -13.9978
            14  C8x C    19.0814  -13.3014
            15  O5x O    14.2763  -11.9782
            16  O5x O    11.9782  -16.0869
            17  C1a C    21.4491  -13.3014
            18  C6a C    21.4491  -16.0869
            19  C1b C    16.7137  -18.3154
            20  C1c C    17.8279  -19.0118
            21  C1c C    19.0118  -18.3154
            22  C1c C    20.1956  -19.0118
            23  C1b C    21.3795  -18.3154
            24  O2b O    22.4937  -19.0118
            25  O1a O    17.8279  -20.4045
            26  O1a O    20.1956  -20.4045
            27  O1a O    19.0118  -16.9226
            28  P1b P    23.8865  -19.0118
            29  O1c O    25.2793  -19.0118
            30  O1c O    23.8865  -17.6190
            31  O1c O    23.8865  -20.4045
            32  O6a O    22.6330  -15.3905
            33  O6a O    21.4491  -17.4869
BOND        35
            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
            35   18  33 1

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