LMFA02000287
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0     0  0            999 V2000
   21.0221    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8954    7.3688    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.0221    8.8815    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.1424    7.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2622    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3821    7.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5020    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6219    7.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7418    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8617    7.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9816    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1015    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2214    7.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3411    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4610    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5809    7.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7009    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8207    7.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9406    7.8731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    7.3688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8617    6.3605    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  1  0  0  0  0
 11 12  2  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  1  0  0  0  0
 10 21  1  1  0  0  0
M  END
> <LM_ID>
LMFA02000287

> <COMMON_NAME>
8R-HODE

> <SYSTEMATIC_NAME>
8R-hydroxy-9Z,12Z-octadecadienoic acid

> <FORMULA>
C18H32O3

> <MASS>
296.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Other Octadecanoids [FA0200]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Laetisaric acid

> <INCHI_KEY>
UKRXAPMQXXXXTD-QMEIEYGNSA-N

> <INCHI>
InChI=1S/C18H32O3/c1-2-3-4-5-6-7-8-11-14-17(19)15-12-9-10-13-16-18(20)21/h6-7,11,14,17,19H,2-5,8-10,12-13,15-16H2,1H3,(H,20,21)/b7-6-,14-11-/t17-/m0/s1

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

> <KEGG_ID>
C08318

> <HMDB_ID>
-

> <CHEBI_ID>
28932

> <ABBREVIATION>
FA 18:2;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5281117

> <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; 228946; 100866

> <CITATION>
21852690; 17774004; 10695920

$$$$