LMFA01050143
  LIPID_MAPS_STRUCTURE_DATABASE

 19 18  0  0  0  0  0  0  0  0999 V2000
   13.7946    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5091    5.6601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2236    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9381    5.6601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6526    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9381    6.4850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9696    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2551    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5407    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8262    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1117    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3973    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5723    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8578    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7144    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8262    6.4849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  4  6  2  0  0  0  0
  1  7  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 12 13  2  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 10 19  1  1  0  0  0
M  END
> <LM_ID>
LMFA01050143

> <COMMON_NAME>
Tetranor-12R-HETE

> <SYSTEMATIC_NAME>
8R-hydroxy-4Z,6E,10Z-hexadecatrienoic acid

> <FORMULA>
C16H26O3

> <MASS>
266.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KBOVKDIBOBQLRS-QCNAHCIUSA-N

> <INCHI>
InChI=1S/C16H26O3/c1-2-3-4-5-6-9-12-15(17)13-10-7-8-11-14-16(18)19/h6-10,13,15,17H,2-5,11-12,14H2,1H3,(H,18,19)/b8-7-,9-6-,13-10+/t15-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
72605

> <ABBREVIATION>
FA 16:3;O

> <CAYMAN_ID>
34565

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5282970

> <LIPIDBANK_ID>
DFA8137

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9606

> <CITATION>
20671299

$$$$