LMFA03010230
  LIPID_MAPS_STRUCTURE_DATABASE

 32 32  0     0  0            999 V2000
    8.9101    8.9666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9101    9.9781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9480   10.2908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3535    9.4722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9480    8.6539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7285   10.5727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6775   10.5766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7285    8.3719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6047    8.8777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4807    8.3719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3569    8.8777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2330    8.3719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1091    8.8777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9852    8.3719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8613    8.8777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6354   11.2529    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4807    7.3603    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6163   10.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4923   10.5727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3685   10.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2446   10.5727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1207   10.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9968   10.5727    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1207    9.2577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6354    7.6919    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7593    7.1860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8832    7.6919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7593    6.1744    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3215    6.8749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3215    5.9042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1621    7.3603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8375   10.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  1  1  0     0  0
  2  6  1  6     0  0
  6  7  2  0     0  0
  1  8  1  1     0  0
  8  9  2  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
  3 16  1  6     0  0
 10 17  1  6     0  0
  7 18  1  0     0  0
 19 18  1  0     0  0
 20 19  1  0     0  0
 21 20  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 22 24  2  0     0  0
  5 25  1  6     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 26 28  2  0     0  0
 17 29  1  0     0  0
 29 30  2  0     0  0
 29 31  1  0     0  0
 23 32  1  0     0  0
M  END
> <LM_ID>
LMFA03010230

> <COMMON_NAME>
Sarcoehrendin I

> <SYSTEMATIC_NAME>
methyl-9S-hydroxy-11R,15S-diacetoxy-6Z,13E-prostadienoate

> <FORMULA>
C25H40O7

> <MASS>
452.28

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Prostaglandins [FA0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YFKVHMFAMUUTDI-HHNLZXQZSA-N

> <INCHI>
InChI=1S/C25H40O7/c1-5-6-9-12-20(31-18(2)26)15-16-22-21(23(28)17-24(22)32-19(3)27)13-10-7-8-11-14-25(29)30-4/h10,13,15-16,20-24,28H,5-9,11-12,14,17H2,1-4H3/b13-10-,16-15+/t20-,21+,22+,23-,24+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 25:5;O5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171037427

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
358800

> <CITATION>
25075977

$$$$