LMFA03060098
  LIPID_MAPS_STRUCTURE_DATABASE

 26 25  0  0  0  0  0  0  0  0999 V2000
    5.0000    7.7224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.8974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    6.8974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    7.7224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    8.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1435    8.1349    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.8580    7.7224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5725    8.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3975    8.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1120    7.7224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8266    8.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5410    7.7224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2555    8.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9700    7.7224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2555    8.9599    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434    6.4849    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.8579    6.8974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5723    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2868    6.8974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0012    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7156    6.8974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1435    8.9598    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434    5.6600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8580    9.3723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8579    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
  9 10  2  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 14 16  2  0  0  0  0
 17  4  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
  7 23  1  1  0  0  0
 17 24  1  6  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
M  END
> <LM_ID>
LMFA03060098

> <COMMON_NAME>
8S,15S-diHPETE

> <SYSTEMATIC_NAME>
8S,15S-dihydroperoxy-5Z,9E,11Z,13E-eicosatetraenoic acid

> <FORMULA>
C20H32O6

> <MASS>
368.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Hydroxy/hydroperoxyeicosatetraenoic acids [FA0306]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CXDIKCDVBUPCCG-HCCKYKKOSA-N

> <INCHI>
InChI=1S/C20H32O6/c1-2-3-8-13-18(25-23)14-9-4-5-10-15-19(26-24)16-11-6-7-12-17-20(21)22/h4-6,9-11,14-15,18-19,23-24H,2-3,7-8,12-13,16-17H2,1H3,(H,21,22)/b5-4-,11-6-,14-9+,15-10+/t18-,19+/m0/s1

> <SMILES>
C(/C=C/[C@@H](OO)C/C=C\CCCC(=O)O)=C/C=C/[C@@H](OO)CCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
136400

> <ABBREVIATION>
FA 20:4;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
52921888

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$