LMFA01030739
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0  0  0  0  0  0  0  0999 V2000
   17.3922    5.4177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1155    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3922    6.0866    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.6636    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9346    5.4176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2056    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4766    5.4176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7477    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0187    5.4176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2897    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5608    5.4176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8318    5.4176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1028    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3738    5.4176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6449    5.8353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9159    6.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1869    6.6706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4579    7.0882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7290    6.6706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.0882    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  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  3  0  0  0  0
 15 16  1  0  0  0  0
 16 17  3  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
M  END
> <LM_ID>
LMFA01030739

> <COMMON_NAME>
9Z-Octadecene-12,14-diynoic acid

> <SYSTEMATIC_NAME>
9Z-Octadecene-12,14-diynoic acid

> <FORMULA>
C18H26O2

> <MASS>
274.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FCCQJXSEMADYEB-KTKRTIGZSA-N

> <INCHI>
InChI=1S/C18H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-3,8,11-17H2,1H3,(H,19,20)/b10-9-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
186992

> <ABBREVIATION>
FA 18:5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9543638

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Octadecanoids [FA02]

> <ALT_SUB_CLASSES>


> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$