LMFA03010279
  LIPID_MAPS_STRUCTURE_DATABASE

 24 24  0     0  0            999 V2000
    7.9925    7.9485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9925    8.9484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0415    9.2574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4537    8.4484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0415    7.6393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8016    9.5361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6676    9.0362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8016    7.3608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6676    7.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5337    7.3608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3997    7.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2658    7.3608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1319    7.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9979    7.3608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8641    7.8608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327   10.2084    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5337    6.3607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6676    9.0362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5337    9.5361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    6.6883    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3997    9.0362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3997    8.0362    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2658    9.5361    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7301    7.3607    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  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
  1  8  1  1  0  0  0
  8  9  2  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
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
  3 16  1  6  0  0  0
 10 17  1  6  0  0  0
  7 18  2  0  0  0  0
 19 18  1  0  0  0  0
 21 19  1  0  0  0  0
  5 20  2  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 15 24  1  0     0  0
M  END
> <LM_ID>
LMFA03010279

> <COMMON_NAME>
20-hydroxy Dinor-PGD2

> <SYSTEMATIC_NAME>
2,3-dinor-9S,15S,20-trihydroxy-11-oxo-5Z,13E-prostadienoic acid

> <FORMULA>
C18H28O6

> <MASS>
340.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Prostaglandins [FA0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
omega-hydroxy Dinor-PGD2; 20-hydroxy Dinor-Prostaglandin D2

> <INCHI_KEY>
CHVMSZVREDFSKW-JEZUUBLBSA-N

> <INCHI>
InChI=1S/C18H28O6/c19-11-5-1-2-6-13(20)9-10-15-14(16(21)12-17(15)22)7-3-4-8-18(23)24/h3-4,9-10,13-16,19-21H,1-2,5-8,11-12H2,(H,23,24)/b4-3-,10-9+/t13-,14+,15+,16-/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:4;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
-

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9544

> <CITATION>
108269

$$$$