KEGG   COMPOUND: C06102
Entry
C06102                      Compound                               
Name
Adipate semialdehyde;
Hexan-1-one-6-carboxylate;
6-Oxohexanoate;
6-Oxohexanoic acid
Formula
C6H10O3
Exact mass
130.063
Mol weight
130.1418
Structure
Reaction
Pathway
map00930  Caprolactam degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.1.1.2         1.1.1.258       1.2.1.4         1.2.1.63        
2.6.1.116       3.7.1.11
Other DBs
PubChem: 8366
ChEBI: 18322 2490
3DMET: B00901
NIKKAJI: J12.274B
KCF data

ATOM        9
            1   C1b C    28.6621  -19.1642
            2   C1b C    29.8783  -19.8575
            3   C1b C    27.4461  -19.8634
            4   C6a C    31.0887  -19.1584
            5   C1b C    26.2359  -19.1702
            6   O6a O    32.3045  -19.8516
            7   O6a O    31.0887  -17.7484
            8   C4a C    25.0197  -19.8752
            9   O4a O    23.7861  -19.1654
BOND        8
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1
            6     4   7 2
            7     5   8 1
            8     8   9 2

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