LMFA04000028
  LIPID_MAPS_STRUCTURE_DATABASE

 25 24  0     0  0            999 V2000
   25.7116    6.3607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.8250    6.8728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9318    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0381    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1446    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2511    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3576    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4641    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5704    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6770    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7834    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8899    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9961    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1026    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2092    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3156    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4220    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5284    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6350    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7414    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8478    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9542    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8772    7.9084    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.8382    7.8678    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  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  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  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  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 12 24  1  0  0  0  0
  2 25  2  0  0  0  0
M  END
> <LM_ID>
LMFA04000028

> <COMMON_NAME>
(+/-)-11-HDoHE

> <SYSTEMATIC_NAME>
(+/-)-11-hydroxy-4Z,7Z,9E,13Z,16Z,19Z-docosahexaenoic acid

> <FORMULA>
C22H32O3

> <MASS>
344.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Other Docosanoids [FA0400]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(+/-)-11-HDHA

> <INCHI_KEY>
LTERDCBCHFKFRI-BGKMTWLOSA-N

> <INCHI>
InChI=1S/C22H32O3/c1-2-3-4-5-6-7-9-12-15-18-21(23)19-16-13-10-8-11-14-17-20-22(24)25/h3-4,6-7,10-16,19,21,23H,2,5,8-9,17-18,20H2,1H3,(H,24,25)/b4-3-,7-6-,13-10-,14-11-,15-12-,19-16+

> <SMILES>
OC(=O)CC/C=C\C/C=C\C=C\C(O)C/C=C\C/C=C\C/C=C\CC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
72794

> <ABBREVIATION>
FA 22:6;O

> <CAYMAN_ID>
33450

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11631564

> <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>
20671299

$$$$