LMFA07010510
  LIPID_MAPS_STRUCTURE_DATABASE

 25 24  0     0  0            999 V2000
   20.2184    9.0318    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.2184    8.2191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0310    7.5842    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.0310    6.6447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2437    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3578    6.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4714    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5848    6.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6984    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8119    6.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9254    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0389    6.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1525    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2659    6.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3795    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4930    6.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6065    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7200    6.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8336    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9470    6.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3320    7.7471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4456    8.2685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5590    7.7471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3320    7.2393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  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
 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
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  2 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 22 25  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010510

> <COMMON_NAME>
WE 18:0/4:0(2Me)

> <SYSTEMATIC_NAME>
octadecyl 2-methyl-butanoate

> <FORMULA>
C23H46O2

> <MASS>
354.35

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(18:0/4:0(2Me))

> <INCHI_KEY>
FMLBCRIMQVKRJY-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C23H46O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-23(24)22(3)5-2/h22H,4-21H2,1-3H3

> <SMILES>
O=C(C(C)CC)OCCCCCCCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
WE 23:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
56935978

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
29026

> <CITATION>
-

$$$$