KEGG   COMPOUND: C17238
Entry
C17238                      Compound                               

Name
S-(Hydroxyphenylacetothiohydroximoyl)-L-cysteine
Formula
C11H14N2O4S
Exact mass
270.0674
Mol weight
270.3049
Structure
Reaction
Pathway
map00966  Glucosinolate biosynthesis
map01210  2-Oxocarboxylic acid metabolism
Enzyme
1.14.14.45      1.14.-.-        4.4.1.-
Other DBs
PubChem: 96023646
ChEBI: 80980
NIKKAJI: J2.806.191I
LinkDB
KCF data

ATOM        18
            1   C8x C    23.5492  -18.9325
            2   C8y C    23.5492  -20.3351
            3   C8x C    24.7639  -21.0365
            4   C8x C    25.9787  -20.3351
            5   C8y C    25.9787  -18.9325
            6   C8x C    24.7639  -18.2312
            7   O1a O    22.3345  -21.0365
            8   C1b C    27.2121  -18.2202
            9   C2c C    28.4196  -18.9172
            10  S2a S    28.4196  -20.3198
            11  N2b N    29.6041  -18.2331
            12  O1b O    30.8002  -18.9238
            13  C1b C    29.6342  -21.0211
            14  C1c C    29.6342  -22.4238
            15  N1a N    28.4254  -23.1218
            16  C6a C    30.8679  -23.1359
            17  O6a O    32.0618  -22.4463
            18  O6a O    30.8683  -24.5428
BOND        18
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     2   7 1
            8     5   8 1
            9     8   9 1
            10    9  10 1
            11    9  11 2
            12   11  12 1
            13   10  13 1
            14   13  14 1
            15   14  15 1 #Up
            16   14  16 1
            17   16  17 1
            18   16  18 2

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