LMFA07070117
  LIPID_MAPS_STRUCTURE_DATABASE

 31 30  0     0  0            999 V2000
   -1.8890    2.4757    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8889    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0550    1.0316    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3901    0.1065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3969    0.8935    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3305   -0.4363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5504   -0.4363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4909    0.1065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4909    0.8382    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4021   -0.4196    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3305   -1.4597    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4021   -1.7467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4910   -1.9443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3305   -2.4757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7757    1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6624    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5491    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4358    1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3225    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2092    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0959    1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9826    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8693    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7560    1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6427    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5294    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4161    1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3028    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1895    1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.0762    1.5129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.9629    1.0316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  5  1  1  0  0  0
  6  4  1  0  0  0  0
  7  4  1  0  0  0  0
  8  7  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
  4  3  1  6  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 14  1  0  0  0  0
  2 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
M  CHG  2  10  -1  11   1
M  END
> <LM_ID>
LMFA07070117

> <COMMON_NAME>
O-3Z,6Z,9Z,12Z-octadecatetraenoyl-R-Carnitine

> <SYSTEMATIC_NAME>
3-[(3Z,6Z,9Z,12Z)-octadecatetraenoyloxy]-4-(trimethylazaniumyl)butanoate

> <FORMULA>
C25H41NO4

> <MASS>
419.30

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Fatty acyl carnitines [FA0707]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
CAR 14:4(3Z,6Z,9Z,12Z)

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171117727

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active (generated by computational methods)

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA07070117

$$$$