LMFA04000012
  LIPID_MAPS_STRUCTURE_DATABASE

 25 24  0  0  0  0  0  0  0  0999 V2000
   20.7983    5.6786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5448    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.7983    6.3689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.0463    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2940    5.6785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5417    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7894    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0371    5.6785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2847    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5325    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7801    5.6785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0278    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2755    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5232    5.6785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7709    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0185    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2662    5.6785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5139    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7616    5.6785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0092    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2570    5.6785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5046    5.6785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7523    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.6785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7616    6.2921    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  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  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  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 19 25  1  6  0  0  0
M  END
> <LM_ID>
LMFA04000012

> <COMMON_NAME>
17S-HDHA

> <SYSTEMATIC_NAME>
17S-hydroxy-4Z,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid

> <FORMULA>
C22H32O3

> <MASS>
344.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Other Docosanoids [FA0400]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SWTYBBUBEPPYCX-YTQNUIGOSA-N

> <INCHI>
InChI=1S/C22H32O3/c1-2-3-15-18-21(23)19-16-13-11-9-7-5-4-6-8-10-12-14-17-20-22(24)25/h3,5-8,11-16,19,21,23H,2,4,9-10,17-18,20H2,1H3,(H,24,25)/b7-5-,8-6-,13-11-,14-12-,15-3-,19-16+/t21-/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB10213

> <CHEBI_ID>
138640

> <ABBREVIATION>
FA 22:6;O

> <CAYMAN_ID>
10009799

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11046191

> <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>
-

$$$$