LMFA03020053
  LIPID_MAPS_STRUCTURE_DATABASE

 25 24  0  0  0  0            999 V2000
   10.8748  -11.3878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6998  -11.3878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1123  -12.1022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9373  -12.1022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3498  -11.3878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1748  -11.3878    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   14.5873  -10.6733    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5873  -12.1022    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   15.4123  -12.1022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1748  -12.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3498  -12.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9373  -13.5312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1123  -13.5312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6998  -14.2456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8748  -14.2456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4623  -13.5312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6373  -13.5312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2248  -12.8167    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.3998  -12.8167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6373  -12.1022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2248  -11.3878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6373  -10.6733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2248   -9.9588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6373   -9.2443    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3998   -9.9588    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  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  1  0  0  0
  6  8  1  0  0  0  0
  8  9  1  6  0  0  0
  8 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  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  6  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
M  END
> <LM_ID>
LMFA03020053

> <COMMON_NAME>
15-Epi-lipoxin B5

> <SYSTEMATIC_NAME>
(5R,6E,8Z,10E,12E,14R,15R,17Z)-5,14,15-trihydroxyicosa-6,8,10,12,17-pentaenoic acid

> <FORMULA>
C20H30O5

> <MASS>
350.21

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Leukotrienes [FA0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
VLLDKSJDBRLUOY-XIFXWWOOSA-N

> <INCHI>
InChI=1S/C20H30O5/c1-2-3-8-14-18(22)19(23)15-10-7-5-4-6-9-12-17(21)13-11-16-20(24)25/h3-10,12,15,17-19,21-23H,2,11,13-14,16H2,1H3,(H,24,25)/b6-4-,7-5+,8-3-,12-9+,15-10+/t17-,18+,19+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0012588

> <CHEBI_ID>
175479

> <ABBREVIATION>
FA 20:5;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
53481476

> <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>
-

$$$$