LMFA03070008
  LIPID_MAPS_STRUCTURE_DATABASE

 23 22  0  0  0  0  0  0  0  0999 V2000
    5.0000    7.3540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.5114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7297    6.0901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4594    6.5114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4594    7.3540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7297    7.7752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1891    6.0901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9188    6.5114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6485    6.0901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4911    6.0901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2208    6.5114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9504    6.0901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3020    7.3540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0317    7.7752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7613    7.3540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4911    7.7752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2208    7.3540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9504    7.7752    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2208    6.8981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7930    6.0901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5227    6.5114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2524    6.0901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1891    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  7  4  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
  9 10  2  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
  5 13  2  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 12 20  2  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
  7 23  1  6  0  0  0
M  END
> <LM_ID>
LMFA03070008

> <COMMON_NAME>
12S-HEPE

> <SYSTEMATIC_NAME>
12S-hydroxy-5Z,8Z,10E,14Z,17Z-eicosapentaenoic acid

> <FORMULA>
C20H30O3

> <MASS>
318.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Hydroxy/hydroperoxyeicosapentaenoic acids [FA0307]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MCRJLMXYVFDXLS-UOLHMMFFSA-N

> <INCHI>
InChI=1S/C20H30O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h3-4,7-11,13-14,17,19,21H,2,5-6,12,15-16,18H2,1H3,(H,22,23)/b4-3-,9-7-,11-8-,13-10-,17-14+/t19-/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB10202

> <CHEBI_ID>
88345

> <ABBREVIATION>
FA 20:5;O

> <CAYMAN_ID>
32550

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283191

> <LIPIDBANK_ID>
DFA8125

> <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>
20671299

$$$$