LMFA01031306
  LIPID_MAPS_STRUCTURE_DATABASE

 24 23  0  0  0  0  0  0  0  0999 V2000
   -0.4307   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4307   -0.7460    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4307    0.7460    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2985   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1668   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0350   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9032   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7715   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6397   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5079   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3762   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2443   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1125   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9808   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8490   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7172   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5855   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4537   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3218   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1901   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.0583   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.9265   -0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.7948   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.6630   -0.7460    0.0000 C   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
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  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
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
> <LM_ID>
LMFA01031306

> <COMMON_NAME>
14E-docosenoic acid

> <SYSTEMATIC_NAME>
14E-docosenoic acid

> <FORMULA>
C22H42O2

> <MASS>
338.32

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MTHLEQRYTJWJKJ-CMDGGOBGSA-N

> <INCHI>
InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h8-9H,2-7,10-21H2,1H3,(H,23,24)/b9-8+

> <SMILES>
C(CCCCCCCCCCCC/C=C/CCCCCCC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 22:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
22590170

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9606

> <CITATION>
37402773

$$$$