LMFA01030167
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0     0  0            999 V2000
   15.1228    6.3608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2567    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9889    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8549    6.3608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7210    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5871    6.3608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4532    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3193    6.3608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1853    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.0514    6.3608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.1853    7.8608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2568    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3907    6.3609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5248    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5247    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6588    6.3609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7928    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7928    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9267    6.3609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    6.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
  9 11  2  0  0  0  0
  2 12  2  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 14 15  2  0  0  0  0
 16 15  1  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
M  END
> <LM_ID>
LMFA01030167

> <COMMON_NAME>
3E,9Z,12Z,15Z-octadecatetraenoic acid

> <SYSTEMATIC_NAME>
3E,9Z,12Z,15Z-octadecatetraenoic acid

> <FORMULA>
C18H28O2

> <MASS>
276.21

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
trans-3, cis-9, cis-12, cis-15-octadecatetraenoic acid; C18:4n-3,6,9,15

> <INCHI_KEY>
JNIPNHCEUZIVID-BPJKAVOUSA-N

> <INCHI>
InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10,15-16H,2,5,8,11-14,17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-,16-15+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5282835

> <LIPIDBANK_ID>
DFA0206

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Octadecanoids [FA02]

> <ALT_SUB_CLASSES>


> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
69904

> <CITATION>
-

$$$$