KEGG   COMPOUND: C00127Help
Entry
C00127                      Compound                               

Name
Glutathione disulfide;
GSSG;
Oxiglutatione;
Oxidized glutathione
Formula
C20H32N6O12S2
Exact mass
612.152
Mol weight
612.6311
Structure
Mol fileKCF fileDB search
Remark
Same as: D00031
Reaction
Pathway
map00480  Glutathione metabolism
map01100  Metabolic pathways
map04216  Ferroptosis
map04918  Thyroid hormone synthesis
Enzyme
1.5.4.1         1.8.1.7         1.8.3.3         1.8.4.1         
1.8.4.2         1.8.4.3         1.8.4.4         1.8.4.7         
1.8.4.9         1.8.5.1         1.8.5.7         1.11.1.9        
1.11.1.12       1.20.4.2        1.21.4.5        2.5.1.-         
2.8.1.3
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  13  Agents affecting sensory organs
   131  Ophthalmic agents
    1319  Others
     D00031  Oxiglutatione (JAN/INN)
BRITE hierarchy
Other DBs
CAS: 27025-41-8
PubChem: 3427
ChEBI: 17858
ChEMBL: CHEMBL1372
PDB-CCD: GDS[PDBj]
3DMET: B01166
NIKKAJI: J415.688I
KCF data Show

ATOM        40
            1   O6a O    24.7800  -13.6500
            2   C6a C    25.9700  -14.3500
            3   C1c C    27.1600  -13.6500
            4   C1b C    28.4200  -14.3500
            5   C1b C    29.6100  -13.6500
            6   C5a C    30.8700  -14.3500
            7   N1b N    32.0600  -13.6500
            8   C1c C    33.2500  -14.3500
            9   C5a C    34.5100  -13.6500
            10  N1b N    35.7000  -14.3500
            11  C1b C    36.8900  -13.6500
            12  C6a C    38.1500  -14.3500
            13  O6a O    39.3400  -13.6500
            14  O6a O    25.9700  -15.7500
            15  O5a O    30.8700  -15.7500
            16  N1a N    27.1600  -12.2500
            17  C1b C    33.2500  -15.7500
            18  O5a O    34.5100  -12.2500
            19  O6a O    38.1500  -15.7500
            20  S3a S    32.0600  -16.4500
            21  S3a S    32.0600  -17.8500
            22  C1b C    33.3200  -18.6200
            23  C1c C    33.3200  -20.0200
            24  C5a C    34.5100  -20.6500
            25  N1b N    32.0600  -20.7200
            26  N1b N    35.7000  -20.0200
            27  C1b C    36.8900  -20.6500
            28  C6a C    38.0800  -20.0200
            29  O5a O    34.5100  -22.1200
            30  O6a O    39.2700  -20.6500
            31  O6a O    38.0800  -18.5500
            32  C5a C    30.8700  -20.0200
            33  C1b C    29.6800  -20.7200
            34  O5a O    30.8700  -18.5500
            35  C1b C    28.4900  -20.0200
            36  C1c C    27.3000  -20.7200
            37  C6a C    26.1100  -20.0200
            38  N1a N    27.3000  -22.1200
            39  O6a O    24.9200  -20.6500
            40  O6a O    26.1100  -18.5500
BOND        39
            1     1   2 1
            2     3   2 1 #Up
            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    2  14 2
            14    6  15 2
            15    3  16 1
            16    8  17 1 #Down
            17    9  18 2
            18   12  19 2
            19   17  20 1
            20   20  21 1
            21   21  22 1
            22   23  22 1 #Up
            23   23  24 1
            24   23  25 1
            25   24  26 1
            26   26  27 1
            27   27  28 1
            28   24  29 2
            29   28  30 1
            30   28  31 2
            31   25  32 1
            32   32  33 1
            33   32  34 2
            34   33  35 1
            35   35  36 1
            36   36  37 1 #Down
            37   36  38 1
            38   37  39 1
            39   37  40 2

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