LMFA01031041
  LIPID_MAPS_STRUCTURE_DATABASE

 18 17  0     0  0            999 V2000
   -0.4308   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4308   -0.7462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4308    0.7462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2989   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1673   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0358   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9042   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7726   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6410   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5095   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3779   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2463   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1147   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9832   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8516   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7200   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7200   -1.7462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5271   -0.0891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  7  2  0     0  0
  7  8  1  0     0  0
  8  9  2  0     0  0
  9 10  1  0     0  0
 10 11  2  0     0  0
 11 12  1  0     0  0
 12 13  2  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 16 17  2  0     0  0
 16 18  1  0     0  0
M  END
> <LM_ID>
LMFA01031041

> <COMMON_NAME>
Corticrocin

> <SYSTEMATIC_NAME>
2E,4E,6E,8E,10E,12E-tetradecahexaenedioic acid

> <FORMULA>
C14H14O4

> <MASS>
246.09

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PXPBPRNNNVMUEY-CZBFJCMTSA-N

> <INCHI>
InChI=1S/C14H14O4/c15-13(16)11-9-7-5-3-1-2-4-6-8-10-12-14(17)18/h1-12H,(H,15,16)(H,17,18)/b3-1+,4-2+,7-5+,8-6+,11-9+,12-10+

> <SMILES>
C(/C=C/C=C/C=C/C=C/C=C/C=C/C(O)=O)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
174273

> <ABBREVIATION>
FA 14:7;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12304001

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
39180

> <CITATION>
20261771

$$$$