LMFA01050458
  LIPID_MAPS_STRUCTURE_DATABASE

 10  9  0     0  0  0  0  0  0999 V2000
    4.5981    1.1550    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.3450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301    0.1550    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -1.3450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -0.3450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.1550    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.2320    0.5210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2320   -1.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.8450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.3450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  9  2  0  0  0  0
  3 10  1  0  0  0  0
  4 10  2  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
M  END
> <LM_ID>
LMFA01050458

> <COMMON_NAME>
(R)-4-Dehydropantoate

> <SYSTEMATIC_NAME>
2-hydroxy-3,3-dimethyl-4-oxo-butanoic acid

> <FORMULA>
C6H10O4

> <MASS>
146.06

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
C01053; AC1L978Q; AKOS006384757; 2-hydroxy-3,3-dimethyl-4-oxobutanoic acid

> <INCHI_KEY>
HVMPYIKTQSOMHA-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C6H10O4/c1-6(2,3-7)4(8)5(9)10/h3-4,8H,1-2H3,(H,9,10)

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

> <KEGG_ID>
C01053

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 6:1;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
439381

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$