LMPR0103540021
  LIPID_MAPS_STRUCTURE_DATABASE

 22 25  0     0  0            999 V2000
    7.8023    9.2356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8023    8.2773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6321    7.7981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4620    9.2356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6321    9.7148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3734    9.5317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6321    6.8398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8023    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4620    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6321   10.6730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9723    9.7148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9723   10.6730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3734   10.6748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9723    7.7981    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1321    8.7564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2946   11.3507    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6321   11.5115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0199    8.7177    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8836    7.3249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8692    7.4933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4620    8.2773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5301    7.0053    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
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  6  4  1  0  0  0  0
  3  7  1  6  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  5 10  1  0  0  0  0
 11 12  1  0  0  0  0
 12 10  1  0  0  0  0
  6 13  1  0  0  0  0
 10 13  1  0  0  0  0
  2 14  1  6  0  0  0
  1 15  1  1  0  0  0
 12 16  2  0  0  0  0
 10 17  1  6  0  0  0
  4 18  1  6  0  0  0
  5 11  1  1     0  0
  2 19  1  0     0  0
 19 20  1  0     0  0
  3 21  1  0  0  0  0
 21  4  1  0  0  0  0
 21 20  1  1     0  0
 20 22  2  0     0  0
M  END
> <LM_ID>
LMPR0103540021

> <COMMON_NAME>
Dendroterpene E

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H20O5

> <MASS>
280.13

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Picrotoxane sesquiterpenoids [PR010354]

> <SYNONYMS>


> <INCHI_KEY>
YKLNVZKUYHNBCF-BJSFWKCMSA-N

> <INCHI>
InChI=1S/C15H20O5/c1-6(2)8-9-7-4-5-14(3)13(18)20-15(7,14)11(16)10(8)19-12(9)17/h6-11,16H,4-5H2,1-3H3/t7-,8-,9+,10+,11+,14+,15-/m0/s1

> <SMILES>
[C@H]1(O)[C@]23OC(=O)[C@@]2(C)CC[C@]3([C@H]2C(=O)O[C@]1([H])[C@H]2C(C)C)[H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171120027

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
94219

> <CITATION>
33331167

$$$$