LMFA03010159
  LIPID_MAPS_STRUCTURE_DATABASE

 26 26  0  0  0  0  0  0  0  0999 V2000
    6.6166    6.3097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6166    7.1526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8149    7.4131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3194    6.7312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8149    6.0492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2986    7.6481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0285    7.2267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2986    5.8142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0285    6.2357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7585    5.8142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4886    6.2357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2185    5.8142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9485    6.2357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6786    5.8142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4086    6.2357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    8.2148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8714    7.2267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6015    7.6481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3315    7.2267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0615    7.6481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7915    7.2267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5215    7.6481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1920    7.2610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8073    7.6162    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1920    6.6833    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  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  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
  7 17  2  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
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
  5 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  2  0  0  0  0
M  END
> <LM_ID>
LMFA03010159

> <COMMON_NAME>
1a,1b-dihomo-15-deoxy-delta-12,14-PGD2

> <SYSTEMATIC_NAME>
1a,1b-dihomo-9S-hydroxy-11-oxo-5Z,12E,14E-prostatrienoic acid

> <FORMULA>
C22H34O4

> <MASS>
362.25

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Prostaglandins [FA0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1a,1b-dihomo-15-deoxy-delta-12,14-Prostaglandin D2

> <INCHI_KEY>
FGAVXMGIBNHPKY-PMRZYBNXSA-N

> <INCHI>
InChI=1S/C22H34O4/c1-2-3-4-5-8-11-14-18-19(21(24)17-20(18)23)15-12-9-6-7-10-13-16-22(25)26/h8-9,11-12,14,19,21,24H,2-7,10,13,15-17H2,1H3,(H,25,26)/b11-8+,12-9-,18-14+/t19-,21+/m1/s1

> <SMILES>
C1(=C/C=C/CCCCC)\C(=O)C[C@H](O)[C@@H]\1C/C=C\CCCCCC(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
165317

> <ABBREVIATION>
FA 22:5;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
16061094

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$