LMFA07070074
  LIPID_MAPS_STRUCTURE_DATABASE

 16 15  0  0  0  0            999 V2000
   16.2000   -7.4737    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   16.9144   -7.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6288   -7.4737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6288   -8.2985    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   16.2000   -8.2985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3431   -7.0612    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4856   -7.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4856   -6.2362    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   16.3105   -6.2362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6607   -6.2362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4856   -5.4114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5456   -9.7313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9591   -9.0149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7864   -9.0149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2000   -9.7313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7571  -10.3267    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  1  5  1  6  0  0  0
  3  6  2  0  0  0  0
  7  1  1  0  0  0  0
  8  7  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
  5 14  1  0  0  0  0
 15 14  2  0  0  0  0
 12 16  1  0  0  0  0
M  CHG  2   4  -1   8   1
M  END
> <LM_ID>
LMFA07070074

> <COMMON_NAME>
Hydroxypropionylcarnitine

> <SYSTEMATIC_NAME>
(3S)-3-[(3-hydroxypropanoyl)oxy]-4-(trimethylazaniumyl)butanoate

> <FORMULA>
C10H19NO5

> <MASS>
233.13

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Fatty acyl carnitines [FA0707]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QJGJXKFJFRSERW-QMMMGPOBSA-N

> <INCHI>
InChI=1S/C10H19NO5/c1-11(2,3)7-8(6-9(13)14)16-10(15)4-5-12/h8,12H,4-7H2,1-3H3/t8-/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0013125

> <CHEBI_ID>
165623

> <ABBREVIATION>
CAR 3:0;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
53481613

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$