LMFA02000322
  LIPID_MAPS_STRUCTURE_DATABASE

 21 21  0     0  0            999 V2000
    7.1292    0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2632   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3971    0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5310   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6651    0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7990   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7990   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9330    0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0670   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9330   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7990    0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6651   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6651   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5310    0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3971   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2632    0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1292   -0.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9952    0.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1292    1.1830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9952   -0.3170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1651   -1.1830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  7  2  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  2  0     0  0
 10 11  1  0     0  0
 12 11  1  1     0  0
 12 13  1  0     0  0
 13 14  1  1     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
  1 19  2  0     0  0
  1 20  1  0     0  0
 12 21  1  0     0  0
 13 21  1  0     0  0
M  END
> <LM_ID>
LMFA02000322

> <COMMON_NAME>
12R,13S-epoxy-6Z,9Z-octadecadienoic acid

> <SYSTEMATIC_NAME>
12R,13S-epoxy-6Z,9Z-octadecadienoic acid

> <FORMULA>
C18H30O3

> <MASS>
294.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Other Octadecanoids [FA0200]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
12(R),13(S)-12(13)-epoxy-6Z,9Z-octadecadienoic acid; (6Z,9Z)-11-((2R,3S)-3-pentyloxiran-2-yl)undeca-6,9-dienoic acid; 12,13-Epoxy-Z,Z-6,9-octadecadienoic acid

> <INCHI_KEY>
TVHXKPMFCYEQTM-ISTBTHKESA-N

> <INCHI>
InChI=1S/C18H30O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h4-5,8,11,16-17H,2-3,6-7,9-10,12-15H2,1H3,(H,19,20)/b5-4-,11-8-/t16-,17+/m0/s1

> <SMILES>
C(O)(=O)CCCC/C=C\C/C=C\C[C@H]1O[C@H]1CCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:3;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
131839813

> <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]; Epoxy fatty acids [FA0107]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$