LMFA07011013
  LIPID_MAPS_STRUCTURE_DATABASE

 16 15  0     0  0            999 V2000
   -2.9188    2.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9188    1.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7872    1.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0556    1.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1872    1.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3240    1.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5444    1.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4076    1.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5444    2.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2759    1.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2768    2.6874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1431    3.1866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1439    4.1865    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0086    2.6860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0078    1.6860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8750    3.1852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  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
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  2  0     0  0
 12 14  1  0     0  0
 14 15  1  0     0  0
 14 16  1  0     0  0
M  END
> <LM_ID>
LMFA07011013

> <COMMON_NAME>
Rhodinyl isobutyrate

> <SYSTEMATIC_NAME>
3,7-dimethyloct-7-en-1-yl 2-methylpropanoate

> <FORMULA>
C14H26O2

> <MASS>
226.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
SFE 8:1(7)(3Me,7Me)/3:0(2Me);SFE(8:1(7)(3Me,7Me)/3:0(2Me))

> <INCHI_KEY>
KHCGLDOOFYZQKU-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C14H26O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h12-13H,1,6-10H2,2-5H3

> <SMILES>
CC(CCCC(C)CCOC(C(C)C)=O)=C

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0037189

> <CHEBI_ID>
171861

> <ABBREVIATION>
SFE 14:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
61085

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty esters [FA07]

> <ALT_SUB_CLASSES>
Short fatty esters [FA0710]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$