LMFA08020161
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0  0  0  0  0  0  0  0999 V2000
   14.2669    6.5429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9743    6.1345    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.2669    7.3597    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5544    6.1345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8415    6.5429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1287    6.1345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4158    6.5429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7029    6.1345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9900    6.5429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2773    6.1345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5644    5.7262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8515    5.3178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1386    5.7261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4258    5.3178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7129    5.3178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.7261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6597    6.6030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5017    6.1100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5017    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1178    6.6235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  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  3  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
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
  2 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
M  END
> <LM_ID>
LMFA08020161

> <COMMON_NAME>
N-(2E,4E,10E,12Z-tetradecatetraen-8-yn-oyl) isobutylamine

> <SYSTEMATIC_NAME>
N-(2E,4E,10E,12Z-tetradecatetraen-8-yn-oyl) isobutylamine

> <FORMULA>
C18H25NO

> <MASS>
271.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty amides [FA08]

> <SUB_CLASS>
N-acyl amines [FA0802]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
N-isobutyltetradeca-2E,4E,10E,12Z-tetraen-8-ynamide

> <INCHI_KEY>
BBSFQPJZOWFJSG-SCQJVDGFSA-N

> <INCHI>
InChI=1S/C18H25NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h4-7,12-15,17H,10-11,16H2,1-3H3,(H,19,20)/b5-4-,7-6+,13-12+,15-14+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
187330

> <ABBREVIATION>
NA 18:6

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11054790

> <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]; Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
41568

> <CITATION>
14510603

$$$$