LMFA11000637
  LIPID_MAPS_STRUCTURE_DATABASE

  8  8  0  0  0  0  0  0  0  0999 V2000
    6.4290    5.4125    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.7145    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    6.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    6.2375    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.1435    6.6500    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  7  1  0  0  0  0
  1  7  1  0  0  0  0
  1  6  1  6  0  0  0
  7  8  1  1  0  0  0
M  END
> <LM_ID>
LMFA11000637

> <COMMON_NAME>
trans-1,2-dimethylcyclohexane

> <SYSTEMATIC_NAME>
trans-1,2-dimethylcyclohexane

> <FORMULA>
C8H16

> <MASS>
112.13

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Hydrocarbons [FA11]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KVZJLSYJROEPSQ-HTQZYQBOSA-N

> <INCHI>
InChI=1S/C8H16/c1-7-5-3-4-6-8(7)2/h7-8H,3-6H2,1-2H3/t7-,8-/m1/s1

> <SMILES>
[C@H]1(C)[C@H](C)CCCC1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
188237

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
23313

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1180

> <CITATION>
10596980

$$$$