LMFA01020277
  LIPID_MAPS_STRUCTURE_DATABASE

  9  8  0  0  0  0  0  0  0  0999 V2000
    6.4313    5.8304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7157    6.2476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1470    6.2476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4276    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.8304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2532    6.9293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0509    6.9681    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8665    5.8304    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1432    7.0819    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  2  0  0  0  0
M  END
> <LM_ID>
LMFA01020277

> <COMMON_NAME>
3-hydroxy-3-methyl-2-oxo-butanoic acid

> <SYSTEMATIC_NAME>
3-hydroxy-3-methyl-2-oxo-butanoic acid

> <FORMULA>
C5H8O4

> <MASS>
132.04

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DNOPJXBPONYBLB-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C5H8O4/c1-5(2,9)3(6)4(7)8/h9H,1-2H3,(H,7,8)

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

> <KEGG_ID>
C04181

> <HMDB_ID>
-

> <CHEBI_ID>
17667

> <ABBREVIATION>
FA 5:1;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
440248

> <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>
Oxo fatty acids [FA0106]; Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$