KEGG   COMPOUND: C18319
Entry
C18319                      Compound                               
Name
2-Methylbutyrate;
2-Methylbutyric acid;
2-Methylbutanoic acid
Formula
C5H10O2
Exact mass
102.0681
Mol weight
102.1317
Structure
Pathway
map04974  Protein digestion and absorption
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0102 Branched fatty acids
    C18319  2-Methylbutanoic acid
Other DBs
CAS: 116-53-0
PubChem: 103061501
ChEBI: 37070
LIPIDMAPS: LMFA01020072
KNApSAcK: C00029461
KCF data

ATOM        7
            1   C1a C     9.6600  -13.2300
            2   C1b C    10.8724  -12.5300
            3   C1c C    12.0849  -13.2300
            4   C6a C    13.2973  -12.5300
            5   O6a O    14.5097  -13.2300
            6   C1a C    12.0849  -14.6298
            7   O6a O    13.2973  -11.1300
BOND        6
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     3   6 1
            6     4   7 2

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