KEGG   COMPOUND: C17232Help
Entry
C17232                      Compound                               

Name
2-Oxo-10-methylthiodecanoic acid;
10-Methylthio-2-decanoic acid
Formula
C11H20O3S
Exact mass
232.1133
Mol weight
232.3397
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00966  Glucosinolate biosynthesis
map01110  Biosynthesis of secondary metabolites
map01210  2-Oxocarboxylic acid metabolism
Enzyme
1.1.1.-         2.6.1.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0106 Oxo fatty acids
    C17232  2-Oxo-10-methylthiodecanoic acid
BRITE hierarchy
Other DBs
PubChem: 96023640
ChEBI: 80977
KNApSAcK: C00007651
NIKKAJI: J2.806.179J
KCF data Show

ATOM        15
            1   C1a C    18.2700  -20.5800
            2   S2a S    19.4824  -21.2800
            3   C1b C    20.6949  -20.5800
            4   C1b C    21.9073  -21.2800
            5   C1b C    23.1197  -20.5800
            6   C1b C    24.3322  -21.2800
            7   C1b C    25.5446  -20.5800
            8   C1b C    26.7570  -21.2800
            9   C1b C    27.9695  -20.5800
            10  C1b C    29.1819  -21.2800
            11  C5a C    30.3944  -20.5800
            12  C6a C    31.6068  -21.2800
            13  O6a O    32.8192  -20.5800
            14  O5a O    30.3944  -19.1801
            15  O6a O    31.6068  -22.6796
BOND        14
            1     1   2 1
            2     2   3 1
            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   11  14 2
            14   12  15 2

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