LMFA03110361
  LIPID_MAPS_STRUCTURE_DATABASE

 25 25  0     0  0            999 V2000
   -0.4435   -0.2562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3372   -0.7682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2312   -0.2562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1252   -0.2562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0192   -0.7682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9133   -0.2562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8073   -0.2562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7013   -0.7682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5953   -0.2562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5425   -0.5823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1455    0.2178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5709    1.0384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6128    0.7454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8127    1.3483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9726    0.8027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0800    1.2576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2397    0.7119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3471    1.1667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5069    0.6211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0275    2.2580    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6143    1.0759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7741    0.5303    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5619    2.0763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8969    1.9857    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8354   -1.5403    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  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
  9  8  1  1  0  0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13  9  1  0     0  0
 13 14  1  1     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 16 20  1  6     0  0
 19 21  1  0     0  0
 21 22  1  0     0  0
 21 23  2  0     0  0
 12 24  1  6     0  0
 10 25  1  6     0  0
M  END
> <LM_ID>
LMFA03110361

> <COMMON_NAME>
5-epe-F3t-IsoP

> <SYSTEMATIC_NAME>
(E,5R)-7-[(1S,2R,3R,5S)-3,5-dihydroxy-2-[(2Z,5Z)-octa-2,5-dienyl]cyclopentyl]-5-hydroxyhept-6-enoic acid

> <FORMULA>
C20H32O5

> <MASS>
352.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Isoprostanes [FA0311]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HWROLEQXRBQBTL-IQZPFESUSA-N

> <INCHI>
InChI=1S/C20H32O5/c1-2-3-4-5-6-7-10-16-17(19(23)14-18(16)22)13-12-15(21)9-8-11-20(24)25/h3-4,6-7,12-13,15-19,21-23H,2,5,8-11,14H2,1H3,(H,24,25)/b4-3-,7-6-,13-12+/t15-,16-,17+,18-,19+/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 20:4;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101398006

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Carbocyclic fatty acids [FA0114]; Hydroxy fatty acids [FA0105]; Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-; -; -

> <TAXONOMY>
32630

> <CITATION>
-

$$$$