LMFA03060121
  LIPID_MAPS_STRUCTURE_DATABASE

 25 24  0     0  0            999 V2000
   -0.4383   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4383   -0.7591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4383    0.7591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3213   -0.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2047   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0881   -0.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9716   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8550   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7384   -0.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6218   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5052   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3886   -0.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2720   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1554   -0.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0388   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9223   -0.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8057   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6891   -0.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5725   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4559   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.3393   -0.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.2227   -0.2531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2720    0.7591    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9223   -1.7714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8057    0.7591    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  2  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  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  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 13 23  1  1  0  0  0
 16 24  1  1  0  0  0
 17 25  1  6  0  0  0
M  END
> <LM_ID>
LMFA03060121

> <COMMON_NAME>
Okeanic acid A

> <SYSTEMATIC_NAME>
11S,14R,15S-trihydroxyeicosa-5Z,8Z,12E,17Z-tetraenoic acid

> <FORMULA>
C20H32O5

> <MASS>
352.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Hydroxy/hydroperoxyeicosatetraenoic acids [FA0306]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GZQLVQZPCXQLAS-OYLNYSRPSA-N

> <INCHI>
InChI=1S/C20H32O5/c1-2-3-9-13-18(22)19(23)16-15-17(21)12-10-7-5-4-6-8-11-14-20(24)25/h3-4,6-7,9-10,15-19,21-23H,2,5,8,11-14H2,1H3,(H,24,25)/b6-4-,9-3-,10-7-,16-15+/t17-,18-,19+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 20:4;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
177586004

> <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>
1458930

> <CITATION>
38300791

$$$$