KEGG   COMPOUND: C21622
Entry
C21622                      Compound                               
Name
S-[(Z)-N-Hydroxy(phenyl)acetimidoyl]-L-glutathione
Formula
C18H24N4O7S
Exact mass
440.1366
Mol weight
440.4708
Structure
Reaction
Enzyme
1.14.14.45      3.4.19.16
Other DBs
PubChem: 340650286
LinkDB
KCF data

ATOM        30
            1   C8y C    15.0412  -18.6668
            2   N2b N    17.5486  -19.9902
            3   C2c C    17.4790  -18.5971
            4   C1b C    16.2253  -17.9703
            5   C1b C    19.9167  -18.4578
            6   S2a S    18.6630  -17.8310
            7   C1c C    21.0311  -17.6917
            8   N1b N    20.9614  -16.2987
            9   C5a C    22.2848  -18.3185
            10  O5a O    23.4688  -17.5524
            11  O5a O    23.3992  -16.1594
            12  C5a C    22.1455  -15.5325
            13  C1b C    22.0759  -14.1396
            14  C1b C    23.3295  -13.4430
            15  C1c C    23.3295  -12.0501
            16  C6a C    22.0759  -11.3536
            17  O6a O    20.8918  -12.0501
            18  O6a O    22.0759   -9.9606
            19  N1a N    24.5135  -11.3536
            20  N1b N    22.2848  -19.7116
            21  C1b C    23.5385  -20.4080
            22  O6a O    22.2848  -22.4975
            23  C6a C    23.5385  -21.8010
            24  O6a O    24.7226  -22.4975
            25  C8x C    13.8020  -17.9650
            26  C8x C    12.6032  -18.6704
            27  C8x C    12.6148  -20.0614
            28  C8x C    13.8540  -20.7632
            29  C8x C    15.0528  -20.0577
            30  O1b O    18.7611  -20.6902
BOND        30
            1     2   3 2
            2     3   4 1
            3     1   4 1
            4     5   6 1
            5     3   6 1
            6     5   7 1
            7     7   8 1 #Down
            8     7   9 1
            9     9  10 2
            10   11  12 2
            11    8  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 2
            17   16  18 1
            18   15  19 1 #Up
            19    9  20 1
            20   20  21 1
            21   22  23 2
            22   21  23 1
            23   23  24 1
            24    1  25 2
            25   25  26 1
            26   26  27 2
            27   27  28 1
            28   28  29 2
            29    1  29 1
            30    2  30 1

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