LMPR0103760001
  LIPID_MAPS_STRUCTURE_DATABASE

 16 18  0  0  0  0  0  0  0  0999 V2000
    6.3099    6.8975    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.3099    6.0725    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.0946    5.8175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5795    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0946    7.1524    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.5253    7.1524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0404    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5253    5.8175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0946    7.9774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3099    8.2323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8250    7.5649    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.3099    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.5649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4045    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8090    7.5649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8090    8.3899    0.0000 O   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  0  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
  9 16  2  0  0  0  0
M  END
> <LM_ID>
LMPR0103760001

> <COMMON_NAME>
(+)-Arnicenone

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H22O

> <MASS>
218.17

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Isocomane sesquiterpenoids [PR010376]

> <SYNONYMS>


> <INCHI_KEY>
RRCHUAUWSLVPRW-PUPMMZHASA-N

> <INCHI>
InChI=1S/C15H22O/c1-10-8-12(16)14(4)11(2)9-13(3)6-5-7-15(10,13)14/h9-10H,5-8H2,1-4H3/t10-,13+,14-,15-/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42608193

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
4246

> <CITATION>
12430727

$$$$