LMFA04010508
  LIPID_MAPS_STRUCTURE_DATABASE

 26 26  0  0  0  0  0  0  0  0999 V2000
   -0.3572   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3572   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3572    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0769   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7969   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5169   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2369   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9569   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6769   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3969   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1169   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7899   -0.6911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5801   -0.4363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0716   -1.1036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5801   -1.7709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7899   -1.5161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1169   -2.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3969   -1.5885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6769   -2.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9569   -1.5885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2369   -2.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5169   -2.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7969   -1.5885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0769   -2.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7936   -2.5677    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6769   -2.8259    0.0000 O   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  1  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  2  0  0  0  0
 10 11  1  0  0  0  0
 12 11  1  6  0  0  0
 12 16  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  1  1  0  0  0
 17 18  2  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  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 15 25  2  0  0  0  0
 19 26  1  1  0  0  0
M  END
> <LM_ID>
LMFA04010508

> <COMMON_NAME>
ent-10-epi-17-J4-NeuroP

> <SYSTEMATIC_NAME>
(4Z,7Z)-9-((1S,5R)-5-((R,1E,5Z)-3-hydroxyocta-1,5-dien-1-yl)-4-oxocyclopent-2-en-1-yl)nona-4,7-dienoic acid

> <FORMULA>
C22H30O4

> <MASS>
358.21

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Neuroprostanes [FA0401]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(17R)-17-J4-NeuroP[10R,14S]

> <INCHI_KEY>
KFGNERRZYLGTOE-LXFLWKKKSA-N

> <INCHI>
InChI=1S/C22H30O4/c1-2-3-8-12-19(23)15-16-20-18(14-17-21(20)24)11-9-6-4-5-7-10-13-22(25)26/h3,5-9,14-20,23H,2,4,10-13H2,1H3,(H,25,26)/b7-5-,8-3-,9-6-,16-15+/t18-,19+,20+/m0/s1

> <SMILES>
C(CC/C=C\C/C=C\C[C@H]1C=CC(=O)[C@@H]1/C=C/[C@H](O)C/C=C\CC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 22:7;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
131840825

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$