LMFA11000644
  LIPID_MAPS_STRUCTURE_DATABASE

 10 10  0  0  0  0  0  0  0  0999 V2000
    5.0000    7.2335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7146    5.9958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7146    7.6459    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.7146    8.4709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289    7.2335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434    5.9958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.4083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289    6.4083    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.4289    5.5834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8456    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  1  0  0  0  0
  3  5  1  0  0  0  0
  1  7  1  0  0  0  0
  7  2  1  0  0  0  0
  2  8  1  0  0  0  0
  8  5  1  0  0  0  0
  3  4  1  1  0  0  0
  8  6  1  6  0  0  0
  8  9  1  1  0  0  0
  9 10  1  0  0  0  0
M  END
> <LM_ID>
LMFA11000644

> <COMMON_NAME>
1-ethyl-trans-1,3-dimethycyclohexane

> <SYSTEMATIC_NAME>
1-ethyl-trans-1,3-dimethycyclohexane

> <FORMULA>
C10H20

> <MASS>
140.16

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Hydrocarbons [FA11]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YLZKVXHQMPWDBJ-ZJUUUORDSA-N

> <INCHI>
InChI=1S/C10H20/c1-4-10(3)7-5-6-9(2)8-10/h9H,4-8H2,1-3H3/t9-,10+/m1/s1

> <SMILES>
C1CC[C@@](CC)(C)C[C@@H]1C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
22213910

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1180

> <CITATION>
10596980

$$$$