LMFA01050012
  LIPID_MAPS_STRUCTURE_DATABASE

  9  8  0  0  0  0  0  0  0  0999 V2000
    7.1432    5.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8578    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5723    5.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2868    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5723    6.2376    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4288    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7144    5.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1432    6.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  3  5  2  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  1  9  1  0  0  0  0
M  END
> <LM_ID>
LMFA01050012

> <COMMON_NAME>
DL-3-hydroxy caproic acid

> <SYSTEMATIC_NAME>
3-hydroxy-hexanoic acid

> <FORMULA>
C6H12O3

> <MASS>
132.08

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HPMGFDVTYHWBAG-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C6H12O3/c1-2-3-5(7)4-6(8)9/h5,7H,2-4H2,1H3,(H,8,9)

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0061652

> <CHEBI_ID>
37035

> <ABBREVIATION>
FA 6:0;O

> <CAYMAN_ID>
24607

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
151492

> <LIPIDBANK_ID>
DFA0278

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$