KEGG   COMPOUND: C09822
Entry
C09822                      Compound                               
Name
Cyclohexane-1-carboxylate;
Cyclohexanecarboxylic acid;
Hexahydrobenzoic acid
Formula
C7H12O2
Exact mass
128.0837
Mol weight
128.169
Structure
Reaction
Pathway
map00362  Benzoate degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Module
M00540  Benzoate degradation, cyclohexanecarboxylic acid =>pimeloyl-CoA
Enzyme
2.3.1.315       6.2.1.-
Other DBs
CAS: 98-89-5
PubChem: 12010
ChEBI: 36096
KNApSAcK: C00000334
PDB-CCD: RXK[PDBj]
3DMET: B01117
NIKKAJI: J38.185C
KCF data

ATOM        9
            1   C1y C    28.8400  -16.6301
            2   C1x C    27.6240  -17.3259
            3   C1x C    30.0502  -17.3259
            4   C6a C    28.8400  -15.2329
            5   C1x C    27.6240  -18.7290
            6   C1x C    30.0502  -18.7290
            7   O6a O    30.0560  -14.5313
            8   O6a O    27.6298  -14.5313
            9   C1x C    28.8400  -19.4247
BOND        9
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     6   9 1

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