LMFA01090051
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0  0  0  0  0  0  0  0999 V2000
   18.1969    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9172    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1969    6.4951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.4714    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7455    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0196    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2937    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5678    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8419    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1161    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3901    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6642    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9383    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2124    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4865    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7606    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0348    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3089    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5830    5.6633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8571    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1312    5.6633    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  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
> <LM_ID>
LMFA01090051

> <COMMON_NAME>
18-fluoro-9Z,12Z-octadecadienoic acid

> <SYSTEMATIC_NAME>
18-fluoro-9Z,12Z-octadecadienoic acid

> <FORMULA>
C18H31FO2

> <MASS>
298.23

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Halogenated fatty acids [FA0109]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
18:2(9Z,12Z)(18F)

> <INCHI_KEY>
XVXSJURWEJNUMY-PQZOIKATSA-N

> <INCHI>
InChI=1S/C18H31FO2/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h1-2,5,7H,3-4,6,8-17H2,(H,20,21)/b2-1-,7-5-

> <SMILES>
C(CCCCCCC/C=C\C/C=C\CCCCCF)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
137802

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
56935806

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Octadecanoids [FA02]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; 

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
4314

> <CITATION>
11958814

$$$$