LMFA04030019
  LIPID_MAPS_STRUCTURE_DATABASE

 26 25  0     0  0            999 V2000
   -0.4379   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4379   -0.7584    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4379    0.7584    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3201   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2026   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0852   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9678   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8503   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7329   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6155   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4980   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3806   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2632   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1457   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0283   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9109   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7935   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6760   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5586   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4412   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.3237   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.2063   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.0889   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.9714   -0.2529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7329    0.7584    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5586    0.7584    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  1  0  0  0  0
 10 11  2  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
  9 25  1  1  0  0  0
 19 26  1  6  0  0  0
M  END
> <LM_ID>
LMFA04030019

> <COMMON_NAME>
7,17-DiHDPA

> <SYSTEMATIC_NAME>
7S,17S-dihydroxy-8E,10Z,13Z,15E,19Z-Docosapentaenoic acid

> <FORMULA>
C22H34O4

> <MASS>
362.25

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Resolvin Ds [FA0403]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
7(S),17(S)-hydroxy DPA

> <INCHI_KEY>
JUBMLVBCKBUAQW-STWMVWSJSA-N

> <INCHI>
InChI=1S/C22H34O4/c1-2-3-10-15-20(23)16-11-7-5-4-6-8-12-17-21(24)18-13-9-14-19-22(25)26/h3,5-8,10-12,16-17,20-21,23-24H,2,4,9,13-15,18-19H2,1H3,(H,25,26)/b7-5-,8-6-,10-3-,16-11+,17-12+/t20-,21+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 22:5;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
91886114

> <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>
32630

> <CITATION>
-

$$$$