KEGG   COMPOUND: C03467
Entry
C03467                      Compound                               
Name
beta-Ketoisocaproate;
beta-Ketoisocaproic acid;
3-Oxo-4-methylpentanoate;
4-Methyl-3-oxopentanoic acid
Formula
C6H10O3
Exact mass
130.063
Mol weight
130.1418
Structure
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0102 Branched fatty acids
    C03467  3-Oxo-4-methylpentanoic acid
Other DBs
PubChem: 6286
ChEBI: 29024
LIPIDMAPS: LMFA01020276
3DMET: B00589
LinkDB
KCF data

ATOM        9
            1   C5a C    27.0900  -20.2300
            2   C1b C    25.8300  -20.9300
            3   C1c C    28.2800  -20.9300
            4   O5a O    27.0900  -18.8300
            5   C6a C    24.6400  -20.2300
            6   C1a C    29.4700  -20.2300
            7   C1a C    28.2800  -22.3300
            8   O6a O    24.6400  -18.8300
            9   O6a O    23.4500  -20.9300
BOND        8
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     3   6 1
            6     3   7 1
            7     5   8 2
            8     5   9 1

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