LMFA11000692
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0  0  0  0  0  0  0  0999 V2000
   12.5248    6.0450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7726    5.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0201    6.0449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2676    5.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5151    6.0449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7625    5.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0100    6.0449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2575    5.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5050    6.0449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7525    5.6138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2676    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7625    5.0000    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
  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
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  4 12  1  0  0  0  0
  6 13  1  0  0  0  0
M  END
> <LM_ID>
LMFA11000692

> <COMMON_NAME>
4,6-Dimethylundecane

> <SYSTEMATIC_NAME>
4,6-Dimethylundecane

> <FORMULA>
C13H28

> <MASS>
184.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Hydrocarbons [FA11]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YXHLCYIRSXOVHP-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C13H28/c1-5-7-8-10-13(4)11-12(3)9-6-2/h12-13H,5-11H2,1-4H3

> <SMILES>
CCCC(C)CC(C)CCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
84285

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
28477

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
119532

> <CITATION>
11357397

$$$$