LMFA02000192
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0  0  0  0  0  0  0  0999 V2000
   17.5591    6.5109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2971    6.0847    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.5591    7.1933    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.8157    6.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0720    6.5109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3282    6.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5845    6.5109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8407    6.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0970    6.5109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3532    6.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6095    6.5109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8658    6.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1220    6.5109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3783    6.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6095    7.1174    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6786    5.6808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9281    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1157    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4104    5.6547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7052    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.6547    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  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 11 15  1  0  0  0  0
 14 16  3  0  0  0  0
 17 16  1  0  0  0  0
 17 18  2  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
M  END
> <LM_ID>
LMFA02000192

> <COMMON_NAME>
9-hydroxy-10E,14Z-octadecadien-12-ynoic acid

> <SYSTEMATIC_NAME>
9-hydroxy-10E,14Z-octadecadien-12-ynoic acid

> <FORMULA>
C18H28O3

> <MASS>
292.20

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Other Octadecanoids [FA0200]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Acetylenic acids; 10,14-Octadecadien-12-ynoic acid, 9-hydroxy-, (E,Z)-

> <INCHI_KEY>
DFVZVNJGUDAZDP-UZWKOAOVSA-N

> <INCHI>
InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h4-5,11,14,17,19H,2-3,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b5-4-,14-11+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
187091

> <ABBREVIATION>
FA 18:4;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5312835

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$