LMFA07070014
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0  0  0  0            999 V2000
    9.0024   -9.1917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8602   -8.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1457   -7.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4313   -8.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7169   -7.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0024   -8.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2879   -7.9542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5747   -7.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2879   -7.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0024   -6.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5735   -6.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8589   -7.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8589   -7.9542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1445   -6.7167    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    9.0024   -5.8917    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    9.0024   -5.0668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2892   -8.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0035   -7.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7169   -5.4793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2879   -5.4793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  6  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  2  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11  9  1  0  0  0  0
 12 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
  9  7  1  0  0  0  0
 10 15  1  0  0  0  0
 15 16  1  0  0  0  0
 17  8  1  0  0  0  0
 18 17  1  0  0  0  0
 15 19  1  0  0  0  0
 15 20  1  0  0  0  0
M  CHG  2  14  -1  15   1
M  END
> <LM_ID>
LMFA07070014

> <COMMON_NAME>
(2E)-octenoylcarnitine

> <SYSTEMATIC_NAME>
3-[(2E)-oct-2-enoyloxy]-4-(trimethylazaniumyl)butanoate

> <FORMULA>
C15H27NO4

> <MASS>
285.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Fatty acyl carnitines [FA0707]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
3-[(2E)-oct-2-enoyloxy]-4-(trimethylammonio)butanoate;trans-2-octenoylcarnitine

> <INCHI_KEY>
LOSHAHDSFZXVCT-MDZDMXLPSA-N

> <INCHI>
InChI=1S/C15H27NO4/c1-5-6-7-8-9-10-15(19)20-13(11-14(17)18)12-16(2,3)4/h9-10,13H,5-8,11-12H2,1-4H3/b10-9+

> <SMILES>
O=C(OC(CC([O-])=O)C[N+](C)(C)C)/C=C/CCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
73037

> <ABBREVIATION>
CAR 8:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
71464472

> <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>
-

> <CITATION>
-

$$$$