LMFA01050433
  LIPID_MAPS_STRUCTURE_DATABASE

 11 10  0  0  0  0  0  0  0  0999 V2000
    5.0000    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7144    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8579    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2869    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0013    6.4850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0013    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7158    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5724    5.6600    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.5724    6.4850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5 10  1  0  0  0  0
 10  6  1  0  0  0  0
  6  8  1  0  0  0  0
  8  7  2  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  6  0  0  0
M  END
> <LM_ID>
LMFA01050433

> <COMMON_NAME>
(S)-3-hydroxyoctanoic acid

> <SYSTEMATIC_NAME>
3S-hydroxyoctanoic acid

> <FORMULA>
C8H16O3

> <MASS>
160.11

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NDPLAKGOSZHTPH-ZETCQYMHSA-N

> <INCHI>
InChI=1S/C8H16O3/c1-2-3-4-5-7(9)6-8(10)11/h7,9H,2-6H2,1H3,(H,10,11)/t7-/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
37100

> <ABBREVIATION>
FA 8:0;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11367166

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$