LMFA03010081
  LIPID_MAPS_STRUCTURE_DATABASE

 28 29  0     0  0            999 V2000
    8.0159    7.9778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0159    8.9962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0473    9.3109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4488    8.4870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0473    7.6631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8400    9.5949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7219    9.0857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8400    7.3791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7219    7.8883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6040    7.3791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4859    7.8883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3679    7.3791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327   10.2795    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6040    6.3607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7403    9.0857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6224    9.5949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5043    9.0857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3863    9.5949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2684    9.0857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1504    9.5949    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2684    8.6019    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    6.6945    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3863    7.3791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8956    6.4971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9141    6.4971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4233    7.3791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9141    8.2610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8956    8.2610    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
  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
  3 13  1  6  0  0  0
 10 14  1  6  0  0  0
  7 15  2  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  2  0  0  0  0
  5 22  1  6  0  0  0
 12 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 23  1  0  0  0  0
M  END
> <LM_ID>
LMFA03010081

> <COMMON_NAME>
17-phenyl-trinor-PGF2alpha

> <SYSTEMATIC_NAME>
9S,11R,15S-trihydroxy-17-phenyl-18,19,20-trinor-5Z,13E-prostadienoic acid

> <FORMULA>
C23H32O5

> <MASS>
388.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Prostaglandins [FA0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
17-phenyl-trinor-Prostaglandin F2alpha

> <INCHI_KEY>
YFHHIZGZVLHBQZ-KDACTHKWSA-N

> <INCHI>
InChI=1S/C23H32O5/c24-18(13-12-17-8-4-3-5-9-17)14-15-20-19(21(25)16-22(20)26)10-6-1-2-7-11-23(27)28/h1,3-6,8-9,14-15,18-22,24-26H,2,7,10-13,16H2,(H,27,28)/b6-1-,15-14+/t18-,19+,20+,21-,22+/m0/s1

> <SMILES>
[C@H]1(/C=C/[C@@H](O)CCC2C=CC=CC=2)[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
73773

> <ABBREVIATION>
FA 23:7;O3

> <CAYMAN_ID>
16810

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283081

> <LIPIDBANK_ID>
XPR1763

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630

> <CITATION>
7582489

$$$$