LMFA07070025
  LIPID_MAPS_STRUCTURE_DATABASE

 31 30  0  0  0  0            999 V2000
   15.2946  -13.8452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5800  -14.2576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0105  -13.8456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2960  -14.2579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0105  -13.0206    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.5814  -13.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8668  -14.2579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1525  -13.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4379  -14.2579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7235  -13.8453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0090  -14.2577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.7249  -14.2581    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5800  -15.0829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2944  -15.4954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0090  -15.0829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7235  -15.4954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4379  -15.0829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1525  -15.4955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8668  -15.0831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5814  -15.4955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4394  -15.4958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0105  -15.4958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.7249  -15.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1540  -15.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0105  -16.3207    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   23.1540  -14.2581    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.8685  -15.4958    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   20.2960  -16.7332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.7250  -16.7332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0105  -17.1457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5814  -13.0205    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 11  1  1  0  0  0  0
  1  2  2  0  0  0  0
 13  2  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  3 12  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 23  1  0  0  0  0
 21 24  1  0  0  0  0
 22 23  1  0  0  0  0
 22 25  1  0  0  0  0
 23 12  1  0  0  0  0
 24 26  2  0  0  0  0
 24 27  1  0  0  0  0
 25 28  1  0  0  0  0
 25 29  1  0  0  0  0
 25 30  1  0  0  0  0
  6 31  1  0  0  0  0
M  CHG  2  25   1  27  -1
M  END
> <LM_ID>
LMFA07070025

> <COMMON_NAME>
(9Z)-3-hydroxyoctadecenoylcarnitine

> <SYSTEMATIC_NAME>
3-{[(9Z)-3-hydroxyoctadec-9-enoyl]oxy}-4-(trimethylazaniumyl)butanoate

> <FORMULA>
C25H47NO5

> <MASS>
441.35

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Fatty acyl carnitines [FA0707]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
3-hydroxyoleoylcarnitine;3-{[(9Z)-3-hydroxyoctadec-9-enoyl]oxy}-4-(trimethylammonio)butanoate;9-cis-3-hydroxyoctadecenoylcarnitine

> <INCHI_KEY>
YBCVTTMMURGSEY-SEYXRHQNSA-N

> <INCHI>
InChI=1S/C25H47NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(27)19-25(30)31-23(20-24(28)29)21-26(2,3)4/h12-13,22-23,27H,5-11,14-21H2,1-4H3/b13-12-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
73076

> <ABBREVIATION>
CAR 18:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
71464558

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$