LMFA07040244
  LIPID_MAPS_STRUCTURE_DATABASE

 30 30  0  0  0  0  0  0  0  0999 V2000
   11.4195   -3.8729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4126   -2.8794    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2896   -4.3636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1533   -3.8611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0239   -4.3517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8876   -3.8491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7581   -4.3398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6217   -3.8372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4922   -4.3278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3559   -3.8253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2264   -4.3159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2403   -5.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3731   -5.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5060   -5.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6389   -5.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7718   -5.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9047   -5.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0376   -5.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1705   -5.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3033   -5.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4362   -5.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5690   -5.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7019   -5.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8349   -5.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9678   -5.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1006   -5.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2335   -5.8590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5690   -4.3689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3692   -5.3560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5014   -5.8530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  3  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
 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
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 22 28  1  0  0  0  0
 28  1  1  0  0  0  0
 12 11  1  0     0  0
 27 29  1  0     0  0
 29 30  1  0     0  0
M  END
> <LM_ID>
LMFA07040244

> <COMMON_NAME>
Octacosan-21-olide

> <SYSTEMATIC_NAME>


> <FORMULA>
C28H54O2

> <MASS>
422.41

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NZOGVPXJSDRABT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C28H54O2/c1-2-3-4-18-21-24-27-25-22-19-16-14-12-10-8-6-5-7-9-11-13-15-17-20-23-26-28(29)30-27/h27H,2-26H2,1H3

> <SMILES>
C1(OC(CCCCCCC)CCCCCCCCCCCCCCCCCCC1)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 28:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
178328625

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33448

> <CITATION>
41875930

$$$$