LMFA01030705
  LIPID_MAPS_STRUCTURE_DATABASE

 18 17  0  0  0  0  0  0  0  0999 V2000
   15.9579    7.3403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6828    6.9217    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9579    8.0106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2277    6.9217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4971    7.3402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7666    6.9217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0360    7.3402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3055    6.9217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5749    7.3402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8444    6.9217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1138    7.3402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3833    6.9217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6527    6.5031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9222    6.0846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1916    5.6660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4611    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7305    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.6660    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  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  3  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  2  0  0  0  0
 17 18  1  0  0  0  0
M  END
> <LM_ID>
LMFA01030705

> <COMMON_NAME>
6E,8E,14Z-Hexadecatriene-10,12-diynoic acid

> <SYSTEMATIC_NAME>
6E,8E,14Z-Hexadecatriene-10,12-diynoic acid

> <FORMULA>
C16H18O2

> <MASS>
242.13

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QRMUVFBZROTBPM-ULTUQXKFSA-N

> <INCHI>
InChI=1S/C16H18O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-3,8-11H,12-15H2,1H3,(H,17,18)/b3-2-,9-8+,11-10+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
197241

> <ABBREVIATION>
FA 16:7

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9543614

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$