LMFA08020165
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0     0  0            999 V2000
   13.2583    1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1243    0.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.8564    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9904    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7224    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8564   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2583    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3923    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9282    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5262    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7942    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0621    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6602    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1961    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5980   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  2  0  0  0  0
  2  4  1  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8 10  2  0  0  0  0
  9 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 11 16  1  0  0  0  0
 12 14  2  0  0  0  0
 13 17  1  0  0  0  0
 15 18  1  0  0  0  0
 17 19  3  0  0  0  0
 18 20  3  0  0  0  0
 19 20  1  0  0  0  0
M  END
> <LM_ID>
LMFA08020165

> <COMMON_NAME>
Anacyclin

> <SYSTEMATIC_NAME>
(2E,4E)-N-isobutyltetradeca-2,4-dien-8,10-diynamide

> <FORMULA>
C18H25NO

> <MASS>
271.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty amides [FA08]

> <SUB_CLASS>
N-acyl amines [FA0802]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
AC1NQY2W; C08396; (2E,4E)-N-(2-Methylpropyl)-2,4-tetradecadiene-8,10-diynamide; (2E,4E)-N-(2-methylpropyl)tetradeca-2,4-dien-8,10-diynamide

> <INCHI_KEY>
CAZNLADLZFVEBY-SQIWNDBBSA-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/h12-15,17H,4-5,10-11,16H2,1-3H3,(H,19,20)/b13-12+,15-14+

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

> <KEGG_ID>
C08396

> <HMDB_ID>
-

> <CHEBI_ID>
2698

> <ABBREVIATION>
NA 18:6

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5281131

> <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>
159698

> <CITATION>
28498323

$$$$