LMFA01030557
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0     0  0            999 V2000
   21.0817    6.5670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9585    6.0607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.0817    7.3778    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.1986    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3149    6.5669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4313    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5476    6.5669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6641    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7804    6.5669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8968    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0133    6.5669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1296    7.0732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2460    7.5794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3623    8.0857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4788    8.5919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5952    8.5919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7115    8.0857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8279    8.5919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9443    8.0857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    8.5919    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  3  0  0  0  0
 12 13  1  0  0  0  0
 13 14  3  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  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>
LMFA01030557

> <COMMON_NAME>
Bolekic acid

> <SYSTEMATIC_NAME>
13Z-octadecene-9,11-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>
13-Octadecene-9,11-diynoic acid, (Z)-

> <INCHI_KEY>
ACHMRCSARDWYGC-WAYWQWQTSA-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/h5-6H,2-4,11-17H2,1H3,(H,19,20)/b6-5-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
183017

> <ABBREVIATION>
FA 18:5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5312685

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Octadecanoids [FA02]

> <ALT_SUB_CLASSES>


> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
350425

> <CITATION>
-

$$$$