KEGG   COMPOUND: C16590Help
Entry
C16590                      Compound                               

Name
7-Oxoheptanoic acid;
7-Ketoheptanoic acid
Formula
C7H12O3
Exact mass
144.0786
Mol weight
144.1684
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00680  Methane metabolism
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0106 Oxo fatty acids
    C16590  7-Oxoheptanoic acid
BRITE hierarchy
Other DBs
PubChem: 51090917
ChEBI: 80588
NIKKAJI: J319.562G
KCF data Show

ATOM        10
            1   C1b C    33.6000  -20.5100
            2   C4a C    34.8600  -21.2100
            3   C1b C    32.4100  -21.2100
            4   O4a O    35.9100  -20.3700
            5   C1b C    31.2200  -20.5100
            6   C1b C    30.0300  -21.2100
            7   C1b C    28.7700  -20.4400
            8   C6a C    27.5800  -21.1400
            9   O6a O    26.3200  -20.4400
            10  O6a O    27.5800  -22.5400
BOND        9
            1     1   2 1
            2     1   3 1
            3     2   4 2
            4     3   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     8  10 2

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