LMPR0103760002
  LIPID_MAPS_STRUCTURE_DATABASE

 15 17  0  0  0  0  0  0  0  0999 V2000
    6.3099    6.6500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.3099    5.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.0946    5.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5795    6.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0946    6.9049    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.5253    6.9049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0404    6.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5253    5.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0946    7.7299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3099    7.9848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8250    7.3174    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.3099    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.3174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4045    6.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8090    7.3174    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  2  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  2  1  0  0  0  0
  5  9  1  6  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  1 11  1  6  0  0  0
  2 12  1  6  0  0  0
 11 13  1  1  0  0  0
  4 14  1  0  0  0  0
  5 15  1  1  0  0  0
M  END
> <LM_ID>
LMPR0103760002

> <COMMON_NAME>
(-)-Isocomene

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H24

> <MASS>
204.19

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C15 isoprenoids (sesquiterpenes) [PR0103]

> <CLASS_LEVEL4>
Isocomane sesquiterpenoids [PR010376]

> <SYNONYMS>


> <INCHI_KEY>
SAOJPWFHRMUCFN-MYPMTAMASA-N

> <INCHI>
InChI=1S/C15H24/c1-11-6-9-14(4)12(2)10-13(3)7-5-8-15(11,13)14/h10-11H,5-9H2,1-4H3/t11-,13+,14+,15-/m0/s1

> <SMILES>
[C@@]123[C@@H](C)CC[C@]1(C)C(C)=C[C@@]2(C)CCC3

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11030948

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$