LMPR0103740002
  LIPID_MAPS_STRUCTURE_DATABASE

 16 18  0     0  0            999 V2000
    8.4655    8.9786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4655    7.9786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4165    7.6696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0044    8.4786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4165    9.2877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5145    9.2877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9266    8.4786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5145    7.6696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8777    7.1696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4655    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4165    6.6696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0044    8.4786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.9786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.9786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9118    6.9108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4655    9.9786    0.0000 H   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  2  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
  2  9  1  6  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  4 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  9 15  1  1  0  0  0
  3 11  1  6  0  0  0
  1 16  1  6     0  0
M  END
> <LM_ID>
LMPR0103740002

> <COMMON_NAME>
pentalenene

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H24

> <MASS>
204.19

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Pentalenane sesquiterpenoids [PR010374]

> <SYNONYMS>


> <INCHI_KEY>
YGIVIHRLDOVJLL-GUIRCDHDSA-N

> <INCHI>
InChI=1S/C15H24/c1-10-7-12-8-14(3,4)9-15(12)11(2)5-6-13(10)15/h7,11-13H,5-6,8-9H2,1-4H3/t11-,12-,13+,15-/m1/s1

> <SMILES>
[C@@]12([H])CC(C)(C)C[C@]31[C@H](C)CC[C@H]3C(C)=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
17251

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11009055

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33903

> <CITATION>
17017767

$$$$