LMFA01050469
  LIPID_MAPS_STRUCTURE_DATABASE

 10  9  0     0  0  0  0  0  0999 V2000
    2.6340   -0.9050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3660    1.0950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0981    0.0950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2320   -1.4050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   -0.4050    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.0000    0.4610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3660    0.0950    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.0000   -1.2710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.4610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2320   -0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  2  7  1  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
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
M  END
> <LM_ID>
LMFA01050469

> <COMMON_NAME>
2,3-Dihydroxy-3-methylpentanoic acid

> <SYSTEMATIC_NAME>
2,3-dihydroxy-3-methyl-pentanoic acid

> <FORMULA>
C6H12O4

> <MASS>
148.07

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
4,5-dideoxy-3-c-methylpentonic acid; pentonic acid, 4,5-dideoxy-3-C-methyl-; 2,3-dihydroxy-3-methylvalerate; 2,3-dihydroxy-3-methylpentanoate

> <INCHI_KEY>
PDGXJDXVGMHUIR-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C6H12O4/c1-3-6(2,10)4(7)5(8)9/h4,7,10H,3H2,1-2H3,(H,8,9)

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

> <KEGG_ID>
C04104

> <HMDB_ID>
-

> <CHEBI_ID>
882

> <ABBREVIATION>
FA 6:0;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
8

> <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>
-

$$$$