LMFA04010002
  LIPID_MAPS_STRUCTURE_DATABASE

 27 27  0     0  0            999 V2000
    4.3300    1.2018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2084    0.6833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3374    1.9667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4352    0.7003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5500    1.2189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6548    0.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7645    0.7261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1207    1.2447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0159    0.7432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9061    0.7518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7914    1.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6235    0.6709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6006    0.9860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2084    0.1608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6006   -0.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6235   -0.3492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7914   -0.9489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9012   -0.4388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0109   -0.9489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1206   -0.4388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7696   -0.9489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6599   -0.9489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5502   -0.4388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4404   -0.9489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8647    1.9689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8647   -1.6497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0109   -1.9689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  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
  6  7  2  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  2  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 16  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  2  0     0  0
 18 19  1  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
 13 25  1  0     0  0
 15 26  1  0     0  0
 19 27  1  0     0  0
M  END
> <LM_ID>
LMFA04010002

> <COMMON_NAME>
17-F4-NeuroP

> <SYSTEMATIC_NAME>
(4Z,7Z)-9-(3,5-dihydroxy-2-((1E,5Z)-3-hydroxyocta-1,5-dien-1-yl)cyclopentyl)nona-4,7-dienoic acid

> <FORMULA>
C22H34O5

> <MASS>
378.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Neuroprostanes [FA0401]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DSZPTRJZWQQVFK-HOGCIABESA-N

> <INCHI>
InChI=1S/C22H34O5/c1-2-3-8-11-17(23)14-15-19-18(20(24)16-21(19)25)12-9-6-4-5-7-10-13-22(26)27/h3,5-9,14-15,17-21,23-25H,2,4,10-13,16H2,1H3,(H,26,27)/b7-5-,8-3-,9-6-,15-14+

> <SMILES>
C(CC/C=C\C/C=C\CC1C(O)CC(O)C1/C=C/C(O)C/C=C\CC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
197143

> <ABBREVIATION>
FA 22:5;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101946675

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$