LMFA01050576
  LIPID_MAPS_STRUCTURE_DATABASE

 19 18  0     0  0            999 V2000
   -3.0610   -0.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9367   -0.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8123   -0.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6880   -0.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5637   -0.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4393   -0.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3149   -0.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1906   -0.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0662   -0.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9420    0.2508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8176    0.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6932    0.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5689    0.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4446    0.2509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.3202    0.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1907   -1.7539    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8175    1.7539    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0576   -1.7539    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1955   -0.2487    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  3  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
  8 16  1  0     0  0
 11 17  1  0     0  0
  1 18  2  0     0  0
  1 19  1  0     0  0
M  END
> <LM_ID>
LMFA01050576

> <COMMON_NAME>
Gallicynoic acid B

> <SYSTEMATIC_NAME>
8,11-dihydroxypentadeca-6Z-en-9-ynoic acid

> <FORMULA>
C15H24O4

> <MASS>
268.17

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
USYGFJALDRCDGW-TWGQIWQCSA-N

> <INCHI>
InChI=1S/C15H24O4/c1-2-3-8-13(16)11-12-14(17)9-6-4-5-7-10-15(18)19/h6,9,13-14,16-17H,2-5,7-8,10H2,1H3,(H,18,19)/b9-6-

> <SMILES>
C(O)(=O)CCCC/C=C\C(O)C#CC(O)CCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 15:3;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171120241

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
76126

> <CITATION>
18247526

$$$$