LMFA03140008
  LIPID_MAPS_STRUCTURE_DATABASE

 26 25  0  0  0  0  0  0  0  0999 V2000
   20.0255    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7441    6.0772    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.0255    7.3218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3016    6.0772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5775    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8534    6.0772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1291    6.4921    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   16.4049    6.0772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6808    6.0772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9566    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2325    6.0772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5081    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7841    6.0772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0600    6.4921    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.3356    6.0772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6116    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8873    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1632    6.0772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4390    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7148    6.0772    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.9906    6.4921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2665    6.0772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1291    7.3218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0600    7.3218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7148    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    6.5223    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  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  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
  7 23  1  1  0  0  0
 14 24  1  1  0  0  0
 20 25  1  1  0  0  0
 22 26  1  0  0  0  0
M  END
> <LM_ID>
LMFA03140008

> <COMMON_NAME>
20-hydroxy-Resolvin E1

> <SYSTEMATIC_NAME>
5S,12R,18S,20-tetrahydroxy-6Z,8E,10E,14Z,16E-eicosapentaenoic acid

> <FORMULA>
C20H30O6

> <MASS>
366.20

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Resolvin Es [FA0314]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
20-hydroxy-RvE1

> <INCHI_KEY>
JTGJRDREFMAMJA-MPPNEBGGSA-N

> <INCHI>
InChI=1S/C20H30O6/c21-16-15-19(24)12-7-3-6-11-17(22)9-4-1-2-5-10-18(23)13-8-14-20(25)26/h1-7,9-10,12,17-19,21-24H,8,11,13-16H2,(H,25,26)/b2-1+,6-3-,9-4+,10-5-,12-7+/t17-,18+,19+/m0/s1

> <SMILES>
C(CCC[C@H](O)/C=C\C=C\C=C\[C@H](O)C/C=C\C=C\[C@@H](O)CCO)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
165269

> <ABBREVIATION>
FA 20:5;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
53477463

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$