LMFA01030494
  LIPID_MAPS_STRUCTURE_DATABASE

 18 17  0  0  0  0  0  0  0  0999 V2000
   15.8716    6.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5907    5.8305    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8716    6.9108    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1471    5.8305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4223    5.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6975    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9727    5.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2479    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5231    5.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7983    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0735    5.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3488    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6240    5.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8992    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1744    5.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4496    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7248    5.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.0000    0.0000 C   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  3  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
 17 18  1  0  0  0  0
M  END
> <LM_ID>
LMFA01030494

> <COMMON_NAME>
2-hexadecynoic acid

> <SYSTEMATIC_NAME>
2-hexadecynoic acid

> <FORMULA>
C16H28O2

> <MASS>
252.21

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
2-Hexadecynoic acid

> <INCHI_KEY>
MECFGCCEVOFCNS-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-13H2,1H3,(H,17,18)

> <SMILES>
C(C#CCCCCCCCCCCCCC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
196088

> <ABBREVIATION>
FA 16:2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
151047

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$