LMFA01030735
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0     0  0            999 V2000
   21.1888    7.8904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.0719    7.3803    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.1888    8.7068    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.2993    7.3803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4094    7.8902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5195    7.3803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6295    7.8902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7396    7.3803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8498    6.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9599    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0699    6.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1800    6.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2901    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4001    6.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5102    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6203    6.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7303    6.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8405    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9506    6.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    6.3607    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  3  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  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
M  END
> <LM_ID>
LMFA01030735

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
9Z,14Z-Octadecadien-6-ynoic acid

> <FORMULA>
C18H28O2

> <MASS>
276.21

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(9Z,14Z)-octa-deca-9,14-di-en-6-ynoic acid

> <INCHI_KEY>
VFYDOTWODCSOBH-ACHWKMRWSA-N

> <INCHI>
InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h4-5,9-10H,2-3,6-8,11,14-17H2,1H3,(H,19,20)/b5-4-,10-9-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
188050

> <ABBREVIATION>
FA 18:4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9543634

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$