LMFA07040151
  LIPID_MAPS_STRUCTURE_DATABASE

 19 19  0     0  0            999 V2000
   -8.2839    0.1588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1482   -0.3441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2873    1.1588    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1448   -1.3441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0160    0.1529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8803   -0.3501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2671    0.6482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1463    1.1519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0256    0.6482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9048    0.1444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7842   -0.3592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6634   -0.3592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5427    0.1443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4069   -0.3587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3536    1.0550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3156    0.3118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1844   -0.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1626   -0.3463    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2223   -1.4677    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  1  3  2  0     0  0
  2  4  1  0     0  0
  2  5  2  0     0  0
  5  6  1  0     0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  3  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
  7 15  1  0     0  0
 15 16  2  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18  7  1  0     0  0
 17 19  2  0     0  0
 14  1  1  0     0  0
M  END
> <LM_ID>
LMFA07040151

> <COMMON_NAME>
(4Z, 8Z)-10-Tigloyloxy matricaria lactone

> <SYSTEMATIC_NAME>
10-[(E)-2-methylbut-2-enoyl]oxydeca-2,4Z,8Z-dien-6-yn-4-olide

> <FORMULA>
C15H14O4

> <MASS>
258.09

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PMCQFFPVAIBCII-SOBNSUNWSA-N

> <INCHI>
InChI=1S/C15H14O4/c1-3-12(2)15(17)18-11-7-5-4-6-8-13-9-10-14(16)19-13/h3,5,7-10H,11H2,1-2H3/b7-5-,12-3+,13-8-

> <SMILES>
C(OC/C=C\C#C/C=C1\OC(=O)C=C\1)(=O)/C(=C/C)/C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 15:8;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171118722

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
59294

> <CITATION>
34688040

$$$$