LMFA07010436
  LIPID_MAPS_STRUCTURE_DATABASE

 12 11  0  0  0  0  0  0  0  0999 V2000
   10.5071    9.0413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5071    8.2260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3223    7.5891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3223    6.6464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5325    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6438    6.6095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7545    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6179    7.7525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7286    8.2755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8391    7.7525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9498    8.2755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    7.7525    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
  2  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
M  END
> <LM_ID>
LMFA07010436

> <COMMON_NAME>
SFE 4:0/6:0

> <SYSTEMATIC_NAME>
butyl hexanoate

> <FORMULA>
C10H20O2

> <MASS>
172.15

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(4:0/6:0)

> <INCHI_KEY>
RPRPDTXKGSIXMD-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C10H20O2/c1-3-5-7-8-10(11)12-9-6-4-2/h3-9H2,1-2H3

> <SMILES>
O=C(CCCCC)OCCCC

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0040211

> <CHEBI_ID>
89561

> <ABBREVIATION>
SFE 10:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12294

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
881510

> <CITATION>
-

$$$$