LMFA01050037
  LIPID_MAPS_STRUCTURE_DATABASE

 15 14  0  0  0  0  0  0  0  0999 V2000
   11.4300    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1445    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8591    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5737    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8591    6.2376    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7156    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0011    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2867    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5722    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8577    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1433    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7144    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4300    6.2375    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
  3  5  2  0  0  0  0
  1  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
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
  1 15  1  0  0  0  0
M  END
> <LM_ID>
LMFA01050037

> <COMMON_NAME>
beta-hydroxylauric acid

> <SYSTEMATIC_NAME>
3-hydroxy-dodecanoic acid

> <FORMULA>
C12H24O3

> <MASS>
216.17

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MUCMKTPAZLSKTL-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C12H24O3/c1-2-3-4-5-6-7-8-9-11(13)10-12(14)15/h11,13H,2-10H2,1H3,(H,14,15)

> <SMILES>
C(O)(CCCCCCCCC)CC(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0000387

> <CHEBI_ID>
36206

> <ABBREVIATION>
FA 12:0;O

> <CAYMAN_ID>
24642

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
94216

> <LIPIDBANK_ID>
DFA0303

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$