LMFA03140011
  LIPID_MAPS_STRUCTURE_DATABASE

 24 23  0     0  0            999 V2000
   23.4474    6.8851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3553    6.3607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.4474    7.7248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.5326    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6174    6.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7024    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7873    6.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8723    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9571    6.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0419    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1269    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2117    6.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2967    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3816    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4664    6.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5514    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6362    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7212    6.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8060    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8909    6.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9759    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    6.8850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7873    7.6313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8909    7.6313    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  1  0  0  0  0
 13 14  2  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
 20 24  1  1  0  0  0
M  END
> <LM_ID>
LMFA03140011

> <COMMON_NAME>
Resolvin E2

> <SYSTEMATIC_NAME>
5S,18R-dihydroxy-6E,8Z,11Z,14Z,16E-eicosapentaenoic acid

> <FORMULA>
C20H30O4

> <MASS>
334.21

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Resolvin Es [FA0314]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
RvE2

> <INCHI_KEY>
KPRHYAOSTOHNQA-NNQKPOSRSA-N

> <INCHI>
InChI=1S/C20H30O4/c1-2-18(21)14-11-9-7-5-3-4-6-8-10-12-15-19(22)16-13-17-20(23)24/h3-4,7-12,14-15,18-19,21-22H,2,5-6,13,16-17H2,1H3,(H,23,24)/b4-3-,9-7-,10-8-,14-11+,15-12+/t18-,19-/m1/s1

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

> <KEGG_ID>
C18173

> <HMDB_ID>
-

> <CHEBI_ID>
81560

> <ABBREVIATION>
FA 20:5;O2

> <CAYMAN_ID>
13827

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
16061125

> <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>
17114001

$$$$