KEGG   COMPOUND: C05727
Entry
C05727                      Compound                               
Name
S-Substituted N-acetyl-L-cysteine;
Mercapturic acid;
N-Acetyl-L-cysteine S-conjugate
Formula
C5H8NO3SR
Structure
Comment
Generic compound in reaction hierarchy
Reaction
Pathway
map00480  Glutathione metabolism
map01100  Metabolic pathways
Enzyme
2.3.1.80        3.5.1.14        3.5.1.114       3.5.1.115
Other DBs
PubChem: 8030
ChEBI: 47911
KCF data

ATOM        11
            1   N1b N    38.7007  -18.3671
            2   C1c C    39.8929  -17.6658
            3   C6a C    41.1551  -18.3671
            4   O6a O    42.3471  -17.6658
            5   C1b C    39.8929  -16.2634
            6   S2a S    41.0849  -15.5621
            7   O6a O    41.1551  -19.7695
            8   R   R    41.0849  -14.1601
            9   C5a C    37.4782  -17.6746
            10  C1a C    36.2664  -18.3878
            11  O5a O    37.4671  -16.2401
BOND        10
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     2   5 1 #Up
            5     5   6 1
            6     3   7 2
            7     6   8 1
            8     1   9 1
            9     9  10 1
            10    9  11 2

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