LMFA07010906
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0     0  0            999 V2000
   -2.0249    0.8241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5246   -0.0423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0249   -0.9086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5246   -1.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0252   -0.9086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5255   -0.0423    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5255   -1.7750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5260   -2.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3922   -3.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2580   -2.7742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1243   -3.2738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9901   -2.7734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8563   -3.2730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  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
M  END
> <LM_ID>
LMFA07010906

> <COMMON_NAME>
WE 6:0/4:0(2ME)

> <SYSTEMATIC_NAME>
hexyl 2-methylbutanoate

> <FORMULA>
C11H22O2

> <MASS>
186.16

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YUECNVSODFDKOQ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C11H22O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h10H,4-9H2,1-3H3

> <SMILES>
CCC(C(OCCCCCC)=O)C

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0039215

> <CHEBI_ID>
156491

> <ABBREVIATION>
WE 11:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
24838

> <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>
36596

> <CITATION>
-

$$$$