LMFA07040124
  LIPID_MAPS_STRUCTURE_DATABASE

 20 20  0     0  0            999 V2000
    8.8032   -4.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6692   -4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5353   -4.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4013   -4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2673   -4.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1332   -4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9993   -4.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8653   -4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7313   -4.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7313   -3.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.5974   -2.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4634   -3.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4634   -4.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5973   -4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5974   -1.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7313   -5.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8653   -5.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9372   -4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0711   -4.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2051   -4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  7  1  0     0  0
  7  8  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14  9  1  0     0  0
 11 15  2  0     0  0
  9 16  1  6     0  0
 16 17  1  0     0  0
  9  8  1  1     0  0
  1 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
M  END
> <LM_ID>
LMFA07040124

> <COMMON_NAME>
Tanikolide

> <SYSTEMATIC_NAME>
5-hydroxymethyl-hexadeca-5R-olide

> <FORMULA>
C17H32O3

> <MASS>
284.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NLAYXWYCDWDTBF-QGZVFWFLSA-N

> <INCHI>
InChI=1S/C17H32O3/c1-2-3-4-5-6-7-8-9-10-13-17(15-18)14-11-12-16(19)20-17/h18H,2-15H2,1H3/t17-/m1/s1

> <SMILES>
C(CCC)CCCCCCC[C@]1(CO)CCCC(=O)O1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 17:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5276592

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
158786

> <CITATION>
10514329

$$$$