LMFA07040247
  LIPID_MAPS_STRUCTURE_DATABASE

 31 31  0  0  0  0  0  0  0  0999 V2000
   11.6507   -6.5139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3204   -7.4413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6249   -6.3385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2692   -7.0904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2437   -6.9151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8880   -7.6670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8626   -7.4917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5069   -8.2437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5582   -8.2870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3338   -7.5645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3304   -6.5743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1828   -6.0704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1794   -5.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3202   -4.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4610   -5.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6017   -4.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7424   -5.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8832   -4.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0240   -5.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1648   -4.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3055   -5.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4463   -4.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5872   -5.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7280   -4.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8686   -5.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0094   -4.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1502   -5.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2910   -4.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5872   -6.0647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4267   -5.0910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5589   -4.5940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  1  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
  8  9  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 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 23 29  1  0     0  0
 29  1  1  0     0  0
 28 30  1  0     0  0
 30 31  1  0     0  0
M  END
> <LM_ID>
LMFA07040247

> <COMMON_NAME>
Nonacosan-22-olide

> <SYSTEMATIC_NAME>


> <FORMULA>
C29H56O2

> <MASS>
436.43

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DUIBBUVLHHGUBC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C29H56O2/c1-2-3-4-19-22-25-28-26-23-20-17-15-13-11-9-7-5-6-8-10-12-14-16-18-21-24-27-29(30)31-28/h28H,2-27H2,1H3

> <SMILES>
C1(OC(CCCCCCC)CCCCCCCCCCCCCCCCCCCC1)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 29:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
178328628

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33448

> <CITATION>
41875930

$$$$