LMFA07010933
  LIPID_MAPS_STRUCTURE_DATABASE

 10  9  0  0  0  0            999 V2000
   -1.4293   -0.8264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4293   -0.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7143    0.4111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7143    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7142    0.4111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0007   -0.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0007   -0.8264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7142   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7143   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4293   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  6  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010933

> <COMMON_NAME>
Methyl (R)-3-methyl-2-oxopentanoate

> <SYSTEMATIC_NAME>
methyl 3-methyl-2-oxopentanoate

> <FORMULA>
C7H12O3

> <MASS>
144.08

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZPSBJVARKCHQDF-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C7H12O3/c1-4-5(2)6(8)7(9)10-3/h5H,4H2,1-3H3

> <SMILES>
CCC(C(C(=O)OC)=O)C

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0037114

> <CHEBI_ID>
168918

> <ABBREVIATION>
SFE 7:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
545106

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Branched fatty acids [FA0102]; Oxo fatty acids [FA0106]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$