LMFA08040030
  LIPID_MAPS_STRUCTURE_DATABASE

 27 26  0  0  0  0  0  0  0  0999 V2000
   19.3768    6.2984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1276    5.8647    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.3768    6.9926    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.6204    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8637    6.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1070    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3503    6.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5937    6.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8370    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0803    6.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3236    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5669    6.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8102    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0535    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2968    6.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5401    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7834    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0268    6.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2701    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5134    6.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7567    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0803    6.9154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3236    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.8294    6.2700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5312    5.8647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2331    6.2700    0.0000 O   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  2  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  1  0  0  0  0
 13 14  2  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
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 10 23  1  0  0  0  0
 11 24  1  0  0  0  0
 25  2  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
M  END
> <LM_ID>
LMFA08040030

> <COMMON_NAME>
8,9-DiHETrE-EA

> <SYSTEMATIC_NAME>
N-((+/-)-8,9-dihydroxy-5Z,11Z,14Z-eicosatrienoyl)-ethanolamine

> <FORMULA>
C22H39NO4

> <MASS>
381.29

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty amides [FA08]

> <SUB_CLASS>
N-acyl ethanolamines (endocannabinoids) [FA0804]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
VBCWCYKNZSTKQW-TYAUOURKSA-N

> <INCHI>
InChI=1S/C22H39NO4/c1-2-3-4-5-6-7-8-9-12-15-20(25)21(26)16-13-10-11-14-17-22(27)23-18-19-24/h6-7,9-10,12-13,20-21,24-26H,2-5,8,11,14-19H2,1H3,(H,23,27)/b7-6-,12-9-,13-10-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
165582

> <ABBREVIATION>
NAE 20:3;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
16061179

> <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>
-

$$$$