LMFA03010286
  LIPID_MAPS_STRUCTURE_DATABASE

 23 23  0     0  0            999 V2000
    7.9927    7.9484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9927    8.9484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0416    9.2573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4538    8.4484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0416    7.6394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8017    9.5361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6676    9.0361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5337    9.5361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3998    9.0361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2657    9.5361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1318    9.0361    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8017    7.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6676    7.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5337    7.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3998    7.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2657    7.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1318    7.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9978    7.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8639    7.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   10.2085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5337    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.6884    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2657   10.5361    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
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  1 12  1  1  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
  3 20  1  6  0  0  0
 14 21  1  6  0  0  0
  5 22  1  6  0  0  0
 10 23  2  0     0  0
M  END
> <LM_ID>
LMFA03010286

> <COMMON_NAME>
2,3-dinor-PGF1alpha

> <SYSTEMATIC_NAME>
9S,11R,15S-trihydroxy-13E-2,3-dinor-prostaenoic acid

> <FORMULA>
C18H32O5

> <MASS>
328.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Prostaglandins [FA0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
2,3-dinor-Prostaglandin F1alpha

> <INCHI_KEY>
XHHYJZGDOMKLEE-IJKMCFRVSA-N

> <INCHI>
InChI=1S/C18H32O5/c1-2-3-4-7-13(19)10-11-15-14(16(20)12-17(15)21)8-5-6-9-18(22)23/h10-11,13-17,19-21H,2-9,12H2,1H3,(H,22,23)/b11-10+/t13-,14+,15+,16-,17+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:2;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101611244

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
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]

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

> <ALT_CLASS_LEVEL4S>
-; -; -; -

> <TAXONOMY>
10116

> <CITATION>
5089691

$$$$