LMFA03010143
  LIPID_MAPS_STRUCTURE_DATABASE

 25 25  0  0  0  0  0  0  0  0999 V2000
    6.5940    6.5574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5940    7.3824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8093    7.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3244    6.9699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8093    6.3025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2614    7.8673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9758    7.4548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6903    7.8673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4048    7.4548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1192    7.8673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8338    7.4548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5482    7.8673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2614    6.0725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9758    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6903    6.0725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4048    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1192    6.0725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    8.4220    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2627    7.4548    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5482    8.6923    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6903    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.5179    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9442    6.0725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6588    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3732    6.0725    0.0000 C   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  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  2  6  1  6  0  0  0
  6  7  1  0  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  0  0  0  0
  1 13  1  1  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  0  0  0  0
  3 18  2  0  0  0  0
 12 19  1  0  0  0  0
 12 20  2  0  0  0  0
 15 21  1  6  0  0  0
  5 22  1  6  0  0  0
 17 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
> <LM_ID>
LMFA03010143

> <COMMON_NAME>
D17 PGE1

> <SYSTEMATIC_NAME>
9-oxo-11R,15S-dihydroxy-13E,17Z-prostadienoic acid

> <FORMULA>
C20H32O5

> <MASS>
352.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Prostaglandins [FA0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
D17 Prostaglandin E1

> <INCHI_KEY>
OFPLGKUICBQJOS-GAFLZONLSA-N

> <INCHI>
InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h3,6,12-13,15-17,19,21,23H,2,4-5,7-11,14H2,1H3,(H,24,25)/b6-3-,13-12+/t15-,16+,17+,19+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
165327

> <ABBREVIATION>
FA 20:4;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283114

> <LIPIDBANK_ID>
XPR1706

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$