LMFA01030394
  LIPID_MAPS_STRUCTURE_DATABASE

 22 21  0     0  0            999 V2000
   23.1467    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0390    6.3605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.1467    7.7010    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.2478    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3485    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4491    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5499    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6506    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7513    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8520    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9527    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0535    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1541    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2548    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3556    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4563    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5569    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6577    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7584    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8591    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9598    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  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  2  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  2  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  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
> <LM_ID>
LMFA01030394

> <COMMON_NAME>
Juniperonic acid

> <SYSTEMATIC_NAME>
5Z,11Z,14Z,17Z-eicosatetraenoic acid

> <FORMULA>
C20H32O2

> <MASS>
304.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
C20:4n-3,6,9,15

> <INCHI_KEY>
JDKIKEYFSJUYJZ-OUJQXAOTSA-N

> <INCHI>
InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10,15-16H,2,5,8,11-14,17-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-,16-15-

> <SMILES>
C(CCC/C=C\CCCC/C=C\C/C=C\C/C=C\CC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
82835

> <ABBREVIATION>
FA 20:4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5312543

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
99809; 9606

> <CITATION>
37402773

$$$$