LMPR0103490002
  LIPID_MAPS_STRUCTURE_DATABASE

 17 19  0  0  0  0  0  0  0  0999 V2000
    6.9685    7.0403    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.9685    6.2826    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.5609    5.8102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2996    5.9788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6284    6.6614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2996    7.3441    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.5609    7.5127    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.3124    7.4191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6562    7.0403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6562    6.2826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3124    5.9038    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.0000    5.9038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5609    8.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1821    5.1540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9398    5.1540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6785    8.0003    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3124    8.1768    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  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  1  1  0  0  0  0
  1  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11  2  1  0  0  0  0
 10 12  1  0  0  0  0
  7 13  1  1  0  0  0
 11  7  1  0  0  0  0
  3 14  1  0  0  0  0
  3 15  1  0  0  0  0
  6 16  1  1  0  0  0
  8 17  2  0  0  0  0
M  END
> <LM_ID>
LMPR0103490002

> <COMMON_NAME>
8beta-Hydroxy-3-longipinen-5-one

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H22O2

> <MASS>
234.16

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Longipinane sesquiterpenoids [PR010349]

> <SYNONYMS>


> <INCHI_KEY>
OHOHYEGETNXOJK-CEJAEVFISA-N

> <INCHI>
InChI=1S/C15H22O2/c1-8-7-9(16)12-13-11(8)15(12,4)10(17)5-6-14(13,2)3/h7,10-13,17H,5-6H2,1-4H3/t10-,11?,12?,13?,15+/m0/s1

> <SMILES>
C12C(=O)C=C(C)C3[C@@]1(C)[C@@H](O)CCC(C)(C)C23

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
184297

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42608168

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$