KEGG   COMPOUND: C00798
Entry
C00798                      Compound                               
Name
Formyl-CoA
Formula
C22H36N7O17P3S
Exact mass
795.1101
Mol weight
795.5442
Structure
Reaction
Pathway
map00630  Glyoxylate and dicarboxylate metabolism
map01100  Metabolic pathways
Enzyme
2.8.3.16        3.1.2.10        4.1.1.8         4.1.2.63
Other DBs
PubChem: 4056
ChEBI: 15522
PDB-CCD: FYN[PDBj]
3DMET: B04726
NIKKAJI: J838.103H
KCF data

ATOM        50
            1   C4a C    30.0749  -31.2200
            2   S2a S    31.2873  -31.9200
            3   C1b C    32.4997  -31.2200
            4   C1b C    33.7122  -31.9200
            5   N1b N    34.9246  -31.2200
            6   C5a C    36.1370  -31.9200
            7   C1b C    37.3495  -31.2200
            8   C1b C    38.5619  -31.9200
            9   N1b N    39.7744  -31.2200
            10  C5a C    40.9868  -31.9200
            11  C1c C    42.1992  -31.2200
            12  C1d C    43.4117  -31.9200
            13  C1b C    44.6241  -31.2200
            14  O2b O    45.8365  -31.9200
            15  O4a O    30.0749  -29.8202
            16  O5a O    36.1370  -33.3199
            17  O5a O    40.9868  -33.3196
            18  O1a O    42.1992  -29.8200
            19  C1a C    43.4117  -30.5200
            20  C1a C    43.4117  -33.3200
            21  P1b P    47.2365  -31.9200
            22  O1c O    48.6365  -31.9200
            23  O1c O    47.2365  -33.3200
            24  C1y C    40.7400  -26.9500
            25  C1y C    42.1400  -26.9500
            26  C1y C    42.5726  -25.6185
            27  O2x O    41.4400  -24.7956
            28  C1y C    40.3074  -25.6185
            29  C1b C    43.8922  -25.1897
            30  O1a O    39.9171  -28.0826
            31  O2b O    42.9629  -28.0826
            32  P1b P    44.3629  -28.0826
            33  O1c O    44.3629  -26.6826
            34  O1c O    45.7629  -28.0826
            35  O1c O    44.3629  -29.4826
            36  C8y C    36.1900  -23.8000
            37  C8y C    36.1900  -25.2000
            38  N4y N    38.6149  -25.2000
            39  C8x C    38.6149  -23.8000
            40  N5x N    37.4024  -23.1000
            41  C8y C    34.9776  -23.1000
            42  N5x N    33.7651  -23.8000
            43  C8x C    33.7651  -25.2000
            44  N5x N    34.9776  -25.9000
            45  N1a N    34.9776  -21.7002
            46  O2b O    45.8745  -25.6220
            47  P1b P    47.2745  -25.6220
            48  O1c O    47.2745  -24.2220
            49  O1c O    48.6745  -25.6220
            50  O2c O    47.2745  -28.8420
BOND        52
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13   13  14 1
            14    1  15 2
            15    6  16 2
            16   10  17 2
            17   11  18 1 #Down
            18   12  19 1
            19   12  20 1
            20   14  21 1
            21   21  22 2
            22   21  23 1
            23   24  25 1
            24   25  26 1
            25   26  27 1
            26   27  28 1
            27   24  28 1
            28   26  29 1 #Down
            29   24  30 1 #Up
            30   25  31 1 #Up
            31   31  32 1
            32   32  33 1
            33   32  34 1
            34   32  35 2
            35   36  37 2
            36   37  38 1
            37   38  39 1
            38   39  40 2
            39   36  40 1
            40   36  41 1
            41   41  42 2
            42   42  43 1
            43   43  44 2
            44   37  44 1
            45   41  45 1
            46   28  38 1 #Down
            47   29  46 1
            48   46  47 1
            49   47  48 1
            50   47  49 2
            51   47  50 1
            52   21  50 1

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