LMFA01050039
  LIPID_MAPS_STRUCTURE_DATABASE

 15 14  0  0  0  0  0  0  0  0999 V2000
   12.1445    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8590    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5736    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2881    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5736    6.2376    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4300    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7156    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0011    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2867    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5722    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8578    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1433    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7144    5.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.4125    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
 14 15  1  0  0  0  0
M  END
> <LM_ID>
LMFA01050039

> <COMMON_NAME>
Sabinic acid

> <SYSTEMATIC_NAME>
12-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>
12-hydroxy lauric acid

> <INCHI_KEY>
ZDHCZVWCTKTBRY-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C12H24O3/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h13H,1-11H2,(H,14,15)

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

> <KEGG_ID>
C08317

> <HMDB_ID>
HMDB0002059

> <CHEBI_ID>
39567

> <ABBREVIATION>
FA 12:0;O

> <CAYMAN_ID>
28494

> <SWISSLIPIDS_ID>
SLM:000389676

> <PUBCHEM_COMPOUND_ID>
79034

> <LIPIDBANK_ID>
DFA0305

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$