LMFA04000118
  LIPID_MAPS_STRUCTURE_DATABASE

 25 24  0  0  0  0  0  0  0  0999 V2000
   -0.4435   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4435   -0.7681    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4435    0.7681    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3370   -0.7681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2309   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1248   -0.7681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0187   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9126   -0.7681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8065   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7004   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5943   -0.7681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4883   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3822   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2761   -0.7681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1700   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0639   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9578   -0.7681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8517   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.7456   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.6395   -0.7681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5334   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.4273   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.3212   -0.7681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.2151   -0.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2309    0.7439    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  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  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  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  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
  5 25  1  0     0  0
M  END
> <LM_ID>
LMFA04000118

> <COMMON_NAME>
3-HDPE

> <SYSTEMATIC_NAME>
3-Hydroxy-7Z,10Z,13Z,16Z,19Z-docosapentaenoic acid

> <FORMULA>
C22H34O3

> <MASS>
346.25

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Other Docosanoids [FA0400]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
TWIXFSBNYDGHKU-JLNKQSITSA-N

> <INCHI>
InChI=1S/C22H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(23)20-22(24)25/h3-4,6-7,9-10,12-13,15-16,21,23H,2,5,8,11,14,17-20H2,1H3,(H,24,25)/b4-3-,7-6-,10-9-,13-12-,16-15-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 22:5;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
151949530

> <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>
Hydroxy fatty acids [FA0105]; Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
32630

> <CITATION>
-

$$$$