LMFA01090047
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0  0  0  0  0  0  0  0999 V2000
   12.1653    5.4105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8764    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1653    6.2316    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4491    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7326    5.4105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0160    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2994    5.4105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5828    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8662    5.4105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1497    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4332    5.4105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7166    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.4105    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
M  END
> <LM_ID>
LMFA01090047

> <COMMON_NAME>
10-fluoro-capric acid

> <SYSTEMATIC_NAME>
10-fluoro-decanoic acid

> <FORMULA>
C10H19FO2

> <MASS>
190.14

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Halogenated fatty acids [FA0109]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
10:0(10F)

> <INCHI_KEY>
LXJHQFGNWFLQTR-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C10H19FO2/c11-9-7-5-3-1-2-4-6-8-10(12)13/h1-9H2,(H,12,13)

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
137794

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9542

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
4314

> <CITATION>
11958814

$$$$