KEGG   COMPOUND: C00848Help
Entry
C00848                      Compound                               

Name
6-Oxocineole;
(1R,4S)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octan-6-one;
2-Oxo-1,8-cineole
Formula
C10H16O2
Exact mass
168.115
Mol weight
168.2328
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Monoterpenoid biosynthesis
Biosynthesis of secondary metabolites
Enzyme
1.1.1.241       1.14.13.51
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0102 C10 isoprenoids (monoterpenes)
    PR010209 Menthane monoterpenoids
     C00848  6-Oxocineole
BRITE hierarchy
Other DBs
CAS: 
70222-88-7
PubChem: 
ChEBI: 
LIPIDMAPS: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        12
            1   C1z C    27.7897  -17.9198
            2   O2x O    29.1598  -18.2065
            3   C5x C    25.9825  -18.3377
            4   C1x C    27.3561  -16.5127
            5   C1a C    28.6480  -17.0883
            6   C1z C    29.1598  -19.3401
            7   C1x C    25.6844  -19.4802
            8   C1x C    26.8528  -17.0696
            9   C1y C    27.5807  -18.9647
            10  C1a C    30.0900  -19.9002
            11  C1a C    29.1598  -20.5114
            12  O5x O    24.9131  -17.2385
BOND        13
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     6   9 1
            9     6  10 1
            10    6  11 1
            11    7   9 1
            12    8   9 1
            13    3  12 2

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