LMFA04020010
  LIPID_MAPS_STRUCTURE_DATABASE

 28 28  0     0  0            999 V2000
   -1.8605    0.6774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9280    1.2159    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8605   -0.0270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7999    1.2156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7398    0.6773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6797    1.2156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6195    0.6773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5593    0.3332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5593   -0.6068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6194   -0.8157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6794   -1.2074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7398   -0.6771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7999   -1.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8601   -0.6771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9203   -1.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0195   -1.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9594   -0.6771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8993   -1.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8392   -1.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7789   -0.6771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7188   -1.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6586   -1.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5985   -0.6771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5384   -1.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1103   -0.0692    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6797    1.9822    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5384   -0.9379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7999   -1.9822    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  7  6  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 16  2  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  2  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 22  2  0     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
  7 25  1  0     0  0
 25 10  1  0     0  0
  6 26  1  0     0  0
  9 27  1  0     0  0
 13 28  1  0     0  0
M  END
> <LM_ID>
LMFA04020010

> <COMMON_NAME>
delta9-5-NeuroF

> <SYSTEMATIC_NAME>
4-hydroxy-4-(4-hydroxy-5-((1E,5Z,8Z,11Z)-3-hydroxytetradeca-1,5,8,11-tetraen-1-yl)tetrahydrofuran-2-yl)butanoic acid

> <FORMULA>
C22H34O6

> <MASS>
394.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Neurofurans [FA0402]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
JBGVKOJKQMZUTJ-GSPMAKDWSA-N

> <INCHI>
InChI=1S/C22H34O6/c1-2-3-4-5-6-7-8-9-10-11-17(23)12-14-20-19(25)16-21(28-20)18(24)13-15-22(26)27/h3-4,6-7,9-10,12,14,17-21,23-25H,2,5,8,11,13,15-16H2,1H3,(H,26,27)/b4-3-,7-6-,10-9-,14-12+

> <SMILES>
C(CCC(O)C1OC(/C=C/C(O)C/C=C\C/C=C\C/C=C\CC)C(O)C1)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 22:5;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44188832

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$