LMFA07010398
  LIPID_MAPS_STRUCTURE_DATABASE

 22 21  0     0  0            999 V2000
   21.9932    6.0607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.1145    6.5681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7977    6.5251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5977    6.0633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7977    7.3088    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.2294    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3438    6.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4582    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5727    6.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6871    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8017    6.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9161    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0306    6.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1450    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2595    6.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3739    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4885    6.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6029    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7174    6.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8318    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9463    6.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  2  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
 21 22  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010398

> <COMMON_NAME>
SFE 18:0/2:0

> <SYSTEMATIC_NAME>
Octadecyl acetate

> <FORMULA>
C20H40O2

> <MASS>
312.30

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OIZXRZCQJDXPFO-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h3-19H2,1-2H3

> <SMILES>
O(C(=O)C)CCCCCCCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179720

> <ABBREVIATION>
SFE 20:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
69968

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
28641

> <CITATION>
5507234

$$$$