LMFA03140003
  LIPID_MAPS_STRUCTURE_DATABASE

 25 24  0     0  0            999 V2000
   23.5308    7.6377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.4432    7.1108    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.5308    8.4813    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.6116    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6921    7.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7727    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8531    7.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9337    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0142    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0946    7.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1752    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2557    7.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3363    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4168    7.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4972    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5777    7.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6582    7.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7386    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8192    7.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8997    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9803    7.6375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    7.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8531    8.3874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4168    8.3874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8997    6.3607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  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  6  0  0  0
M  END
> <LM_ID>
LMFA03140003

> <COMMON_NAME>
Resolvin E1

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

> <FORMULA>
C20H30O5

> <MASS>
350.21

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Resolvin Es [FA0314]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AOPOCGPBAIARAV-OTBJXLELSA-N

> <INCHI>
InChI=1S/C20H30O5/c1-2-17(21)11-8-5-9-14-18(22)12-6-3-4-7-13-19(23)15-10-16-20(24)25/h3-9,11-13,17-19,21-23H,2,10,14-16H2,1H3,(H,24,25)/b4-3+,9-5-,11-8+,12-6+,13-7-/t17-,18+,19-/m1/s1

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

> <KEGG_ID>
C18171

> <HMDB_ID>
HMDB10410

> <CHEBI_ID>
81559

> <ABBREVIATION>
FA 20:5;O3

> <CAYMAN_ID>
10007848

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10473088

> <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>
9606

> <CITATION>
15753205

$$$$