KEGG   COMPOUND: C17622
Entry
C17622                      Compound                               

Name
(6E)-8-Oxogeranial;
10-Oxogeranial;
8-Oxogeranial
Formula
C10H14O2
Exact mass
166.0994
Mol weight
166.217
Structure
Reaction
Pathway
map00902  Monoterpenoid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.1.1.324       1.3.1.122       1.3.1.123
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Monoterpenoids (C10)
   Linear monoterpenes
    C17622  10-Oxogeranial
Other DBs
PubChem: 96023966
ChEBI: 64239
PDB-CCD: XOG[PDBj]
NIKKAJI: J1.586.658F
LinkDB
KCF data

ATOM        12
            1   O4a O    11.1524   -7.3500
            2   C4a C    12.3649   -8.0500
            3   C2c C    13.5773   -7.3500
            4   C2b C    14.7897   -8.0500
            5   C1b C    16.0022   -7.3500
            6   C1b C    17.2146   -8.0500
            7   C2c C    18.4270   -7.3500
            8   C2b C    19.6395   -8.0500
            9   C4a C    20.8519   -7.3500
            10  O4a O    22.0644   -8.0500
            11  C1a C    18.4270   -5.9500
            12  C1a C    13.5773   -5.9500
BOND        11
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 2
            8     8   9 1
            9     9  10 2
            10    7  11 1
            11    3  12 1

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