KEGG   COMPOUND: C06069Help
Entry
C06069                      Compound                               

Name
Iridodial;
cis-trans-Iridodial
Formula
C10H16O2
Exact mass
168.115
Mol weight
168.2328
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
(+)-Iridodial (tautomer) [CPD:C09785]
cis-trans-Iridodial lactol (tautomer) [CPD:C09804]
Reaction
Pathway
Monoterpenoid biosynthesis
Metabolic pathways
Biosynthesis of secondary metabolites
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0102 C10 isoprenoids (monoterpenes)
    PR010207 Iridoid, 10-alkyliridoid and secoiridoid monoterpenoids
     C06069  Iridodial
Phytochemical compounds [BR:br08003]
 Terpenoids
  Monoterpenoids (C10)
   Iridoids
    C06069  Iridodial
BRITE hierarchy
Other DBs
CAS: 
550-45-8
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        12
            1   C1y C    16.4058  -16.9847
            2   C1x C    16.8522  -18.3135
            3   C1x C    18.2539  -18.3697
            4   C1y C    18.6740  -16.9622
            5   C1y C    17.5317  -16.1496
            6   C1c C    19.8800  -16.2661
            7   C4a C    21.0940  -16.9670
            8   C1a C    19.8801  -14.8645
            9   C4a C    17.5175  -14.7244
            10  C1a C    15.0794  -16.5679
            11  O4a O    18.7445  -13.9993
            12  O4a O    22.2857  -16.2792
BOND        12
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     4   6 1
            7     6   7 1
            8     6   8 1 #Down
            9     5   9 1 #Up
            10    1  10 1 #Down
            11    9  11 2
            12    7  12 2

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