LMFA03110042
  LIPID_MAPS_STRUCTURE_DATABASE

 25 25  0  0  0  0  0  0  0  0999 V2000
    9.7437    7.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5151    7.5691    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7437    6.5409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9666    7.5689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1891    7.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4117    7.5689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6342    7.1234    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.8567    7.4609    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4248    6.8130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7704    6.1111    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.6342    6.3271    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.4117    5.8952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1891    6.3271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9666    5.8952    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.7440    6.3271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5215    5.8952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2989    5.8952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0764    6.3271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8539    5.8952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6313    6.3271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4088    5.8952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1862    6.3271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6948    8.0409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.6038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9666    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  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
  7  6  1  1  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  1  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  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  1  0  0  0  0
  7 11  1  0  0  0  0
  8 23  1  6  0  0  0
 10 24  1  6  0  0  0
 14 25  1  6  0  0  0
M  END
> <LM_ID>
LMFA03110042

> <COMMON_NAME>
12-F2t-IsoP

> <SYSTEMATIC_NAME>
6S,8R,12S-trihydroxy-10E,14Z-prostadienoic acid-cyclo[5S,9R]

> <FORMULA>
C20H34O5

> <MASS>
354.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Isoprostanes [FA0311]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(6S,8R,12S)-12-F2-IsoP[5S,9R]

> <INCHI_KEY>
ZOCFIYOANZRNDX-GSMXCAORSA-N

> <INCHI>
InChI=1S/C20H34O5/c1-2-3-4-5-6-7-9-15(21)12-13-17-16(10-8-11-20(24)25)18(22)14-19(17)23/h6-7,12-13,15-19,21-23H,2-5,8-11,14H2,1H3,(H,24,25)/b7-6-,13-12+/t15-,16-,17+,18-,19+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 20:3;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10915226

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$