LMFA07010435
  LIPID_MAPS_STRUCTURE_DATABASE

 11 10  0  0  0  0  0  0  0  0999 V2000
   10.5276    9.0551    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5276    8.2361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3465    7.5963    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3465    6.6493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5532    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6604    6.6121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6344    7.7604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7409    8.2857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8475    7.7604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9541    8.2857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    7.7604    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
  2  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
M  END
> <LM_ID>
LMFA07010435

> <COMMON_NAME>
SFE 3:0/6:0

> <SYSTEMATIC_NAME>
propyl hexanoate

> <FORMULA>
C9H18O2

> <MASS>
158.13

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(3:0/6:0); propionyl hexanoate

> <INCHI_KEY>
HTUIWRWYYVBCFT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C9H18O2/c1-3-5-6-7-9(10)11-8-4-2/h3-8H2,1-2H3

> <SMILES>
O=C(CCCCC)OCCC

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0034165

> <CHEBI_ID>
87365

> <ABBREVIATION>
WE 9:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12293

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
3750

> <CITATION>
24414891

$$$$