KEGG   COMPOUND: C01031
Entry
C01031                      Compound                               
Name
S-Formylglutathione
Formula
C11H17N3O7S
Exact mass
335.0787
Mol weight
335.34
Structure
Reaction
Pathway
map00680  Methane metabolism
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
1.1.1.284       3.1.2.12
Other DBs
CAS: 50409-81-9
PubChem: 4274
ChEBI: 16225
NIKKAJI: J1.171.612A
KCF data

ATOM        22
            1   C1c C    28.4354  -15.2951
            2   C5a C    29.6033  -14.6243
            3   N1b N    27.2613  -14.6243
            4   C1b C    28.4541  -16.8980
            5   N1b N    31.0012  -15.6120
            6   O5a O    29.6033  -13.4106
            7   C5a C    26.0933  -15.2951
            8   S2a S    27.1557  -17.6496
            9   C1b C    24.9192  -14.6243
            10  O5a O    26.0933  -16.7199
            11  C4a C    27.1557  -18.9977
            12  C1b C    23.7512  -15.2951
            13  O4a O    25.9877  -19.6749
            14  C1c C    22.5836  -14.6243
            15  C6a C    21.4093  -15.2951
            16  N1a N    22.5836  -13.2700
            17  O6a O    20.2414  -14.6181
            18  O6a O    21.4155  -16.7199
            19  C1b C    32.2399  -14.9077
            20  C6a C    33.4636  -15.6141
            21  O6a O    34.6872  -14.9077
            22  O6a O    33.4636  -17.0268
BOND        21
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 1
            8     7   9 1
            9     7  10 2
            10    8  11 1
            11    9  12 1
            12   11  13 2
            13   12  14 1
            14   14  15 1
            15   14  16 1 #Up
            16   15  17 1
            17   15  18 2
            18    5  19 1
            19   19  20 1
            20   20  21 1
            21   20  22 2

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