LMFA01050452
  LIPID_MAPS_STRUCTURE_DATABASE

 10  9  0  0  0  0            999 V2000
    8.2974   -2.9945    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0105   -3.4095    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.5807   -3.4095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7011   -2.2815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8825   -2.2815    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7271   -2.9945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0067   -4.3104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8715   -3.0020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4327   -3.4095    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7235   -2.1683    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  1  6  0  0  0
  1  5  1  1  0  0  0
  2  6  1  0  0  0  0
  2  7  1  6  0  0  0
  3  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  2  0  0  0  0
M  END
> <LM_ID>
LMFA01050452

> <COMMON_NAME>
(R) 2,3-Dihydroxy-3-methylvalerate

> <SYSTEMATIC_NAME>
(2R,3R)-2,3-dihydroxy-3-methylpentanoic 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>


> <INCHI_KEY>
PDGXJDXVGMHUIR-UJURSFKZSA-N

> <INCHI>
InChI=1S/C6H12O4/c1-3-6(2,10)4(7)5(8)9/h4,7,10H,3H2,1-2H3,(H,8,9)/t4-,6+/m0/s1

> <SMILES>
[C@](O)(C)(CC)[C@@H](O)C(=O)O

> <KEGG_ID>
C06007

> <HMDB_ID>
HMDB0012140

> <CHEBI_ID>
27512

> <ABBREVIATION>
FA 6:0;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
448154

> <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>
-

$$$$