LMFA07070132
  LIPID_MAPS_STRUCTURE_DATABASE

 24 23  0     0  0            999 V2000
   -1.8578    2.4348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8577    1.4879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0376    1.0146    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3837    0.1048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3904    0.8787    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3085   -0.4291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5413   -0.4291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4662    0.1048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4662    0.8243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3624   -0.4126    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3085   -1.4356    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3624   -1.7178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4829   -1.9122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3085   -2.4348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7298    1.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6018    1.4879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4739    1.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3459    1.4879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2179    1.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0900    1.4879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9620    1.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8340    1.4879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7061    1.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6018    2.4879    0.0000 O   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  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 16 24  1  6     0  0
M  CHG  2  10  -1  11   1
M  END
> <LM_ID>
LMFA07070132

> <COMMON_NAME>
3S-hydroxydecanoylcarnitine

> <SYSTEMATIC_NAME>
3S-{[-3-hydroxydecanoyl]oxy}-4-(trimethylazaniumyl)butanoate

> <FORMULA>
C17H33NO5

> <MASS>
331.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Fatty acyl carnitines [FA0707]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
VCRSQDIROUELAR-LSDHHAIUSA-N

> <INCHI>
InChI=1S/C17H33NO5/c1-5-6-7-8-9-10-14(19)11-17(22)23-15(12-16(20)21)13-18(2,3)4/h14-15,19H,5-13H2,1-4H3/t14-,15+/m0/s1

> <SMILES>
O=C(C[C@@H](O)CCCCCCC)O[C@](CC([O-])=O)(C[N+](C)(C)C)[H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
CAR 10:0;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171117754

> <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>
-

$$$$