LMFA07040125
  LIPID_MAPS_STRUCTURE_DATABASE

 36 36  0     0  0            999 V2000
   10.6421   -4.7266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6421   -3.7274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6413   -4.7266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6413   -3.7274    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9355   -3.0208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3479   -5.4332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4350   -6.4287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6164   -7.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7198   -6.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8545   -7.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9890   -6.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1237   -7.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2582   -6.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3929   -7.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5275   -6.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6622   -7.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7967   -6.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9314   -7.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9355   -5.4332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0615   -4.9488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2049   -5.4635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3310   -4.9790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4744   -5.4937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6005   -5.0092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7439   -5.5238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8700   -5.0394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0134   -5.5540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1395   -5.0696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2830   -5.5843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4090   -5.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4475   -5.6145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3214   -5.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1780   -5.6446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0519   -5.1602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9085   -5.6749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7824   -5.1905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  3  4  1  0     0  0
  4  2  1  0     0  0
  2  5  2  0     0  0
  3  6  1  1     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 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
  1 19  1  6     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
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  0     0  0
  9  8  1  0     0  0
M  END
> <LM_ID>
LMFA07040125

> <COMMON_NAME>
Nocardiolactone

> <SYSTEMATIC_NAME>
2S-octadecanyl-hexadecan-3S-olide

> <FORMULA>
C34H66O2

> <MASS>
506.51

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
trans-3-Octadecyl-4-tridecyloxetan-2-one

> <INCHI_KEY>
RKOCOEJHUKVQSU-LQJZCPKCSA-N

> <INCHI>
InChI=1S/C34H66O2/c1-3-5-7-9-11-13-15-16-17-18-19-21-22-24-26-28-30-32-33(36-34(32)35)31-29-27-25-23-20-14-12-10-8-6-4-2/h32-33H,3-31H2,1-2H3/t32-,33-/m0/s1

> <SMILES>
[C@H]1(CCCCCCCCCCCCCCCCCC)[C@H](CCCCCCCCCCCCC)OC1=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 34:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11214333

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
37326

> <CITATION>
-

$$$$