LMFA01050184
  LIPID_MAPS_STRUCTURE_DATABASE

 19 18  0  0  0  0  0  0  0  0999 V2000
   15.4839    6.0400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2269    5.6108    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4839    6.7271    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7353    5.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9864    6.0400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2376    5.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4887    6.0400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7398    5.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9910    6.0400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2421    5.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4932    6.0400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7443    5.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9955    6.0400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2466    5.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4977    6.0400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7489    5.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9864    6.6506    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2466    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  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
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
  5 18  1  0  0  0  0
 14 19  1  0  0  0  0
M  END
> <LM_ID>
LMFA01050184

> <COMMON_NAME>
Turpetholic acid A

> <SYSTEMATIC_NAME>
3,12-dihydroxy-pentadecanoic acid

> <FORMULA>
C15H30O4

> <MASS>
274.21

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FSZLBXAVPUVPDY-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H30O4/c1-2-9-13(16)10-7-5-3-4-6-8-11-14(17)12-15(18)19/h13-14,16-17H,2-12H2,1H3,(H,18,19)

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
168912

> <ABBREVIATION>
FA 15:0;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5312756

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$