LMFA03010099
  LIPID_MAPS_STRUCTURE_DATABASE

 33 33  0     0  0            999 V2000
    9.1788    9.2370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1788   10.2790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1876   10.6011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5752    9.7579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1876    8.9149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0219   10.8916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9245   10.3706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0219    8.6244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9245    9.1455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8270    8.6244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7295    9.1455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6320    8.6244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5346    9.1455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4371    8.6244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3396    9.1455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8657   11.5923    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8270    7.5822    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9666   10.3706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8691   10.8916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7716   10.3706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6742   10.8916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5767   10.3706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4792   10.8916    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5767    9.5369    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8657    7.9238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9632    7.4027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.9238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9632    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5346    9.9530    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6855    9.5262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0342    9.9170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6855    9.0573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3817   10.3706    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
 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
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
  5 25  1  6  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  2  0  0  0  0
 13 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  2  0  0  0  0
 23 33  1  0  0  0  0
M  END
> <LM_ID>
LMFA03010099

> <COMMON_NAME>
18-acetoxy-PGF2alpha-11-acetate methyl ester

> <SYSTEMATIC_NAME>
methyl 9S,15S-dihydroxy-11R,18-diacetoxy-5Z,13E-prostadienoate

> <FORMULA>
C25H40O8

> <MASS>
468.27

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Prostaglandins [FA0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
18-acetoxy-Prostaglandin F2alpha-11-acetate methyl ester

> <INCHI_KEY>
DILYBEDJTMAIIY-IJALTSKHSA-N

> <INCHI>
InChI=1S/C25H40O8/c1-5-20(32-17(2)26)14-12-19(28)13-15-22-21(23(29)16-24(22)33-18(3)27)10-8-6-7-9-11-25(30)31-4/h6,8,13,15,19-24,28-29H,5,7,9-12,14,16H2,1-4H3/b8-6-,15-13+/t19-,20?,21+,22+,23-,24+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
185727

> <ABBREVIATION>
FA 25:5;O6

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283091

> <LIPIDBANK_ID>
XPR8053

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
2486328

> <CITATION>
-

$$$$