LMFA03010276
  LIPID_MAPS_STRUCTURE_DATABASE

 25 25  0     0  0            999 V2000
    7.9414    7.9002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9414    8.9005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9901    9.2096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4021    8.4004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9901    7.5910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7508    9.4885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6171    8.9883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7508    7.3123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6171    7.8124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4835    7.3123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3498    7.8124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2161    7.3123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0824    7.8124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9489    7.3123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8153    7.8124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6810   10.1610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4835    6.3119    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6175    8.9883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4838    9.4885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3502    8.9883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2166    9.4885    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6810    6.6397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3502    7.9960    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6813    7.3123    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8154    8.8124    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  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
 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  2  0  0  0  0
  7 18  2  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
  5 22  2  0  0  0  0
 20 23  2  0     0  0
 15 24  1  0     0  0
 15 25  2  0     0  0
M  END
> <LM_ID>
LMFA03010276

> <COMMON_NAME>
omega-carboxy-2,3-dinor-13,14-dihydro-15-keto-PGD2

> <SYSTEMATIC_NAME>
11,15-dioxo-9S-hydroxy-2,3-dinor-5Z-prosten-1,20-dioic acid

> <FORMULA>
C18H26O7

> <MASS>
354.17

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Prostaglandins [FA0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
20-carboxy-2,3-dinor-13,14-dihydro-15-keto-Prostaglandin D2

> <INCHI_KEY>
OKEVQLMJQDDRLO-MDQLWMCGSA-N

> <INCHI>
InChI=1S/C18H26O7/c19-12(5-1-3-7-17(22)23)9-10-14-13(15(20)11-16(14)21)6-2-4-8-18(24)25/h2,4,13-15,20H,1,3,5-11H2,(H,22,23)(H,24,25)/b4-2-/t13-,14-,15+/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:5;O5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
-

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]; 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]; Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Carbocyclic fatty acids [FA0114]; Oxo fatty acids [FA0106]; Hydroxy fatty acids [FA0105]; Unsaturated fatty acids [FA0103]; Dicarboxylic acids [FA0117]

> <ALT_CLASS_LEVEL4S>
-; -; -; -; -

> <TAXONOMY>
9541

> <CITATION>
108269

$$$$