KEGG   COMPOUND: C06523Help
Entry
C06523                      Compound                               

Name
Coniine;
(+)-Coniine;
Cicutin
Formula
C8H17N
Exact mass
127.1361
Mol weight
127.2273
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01060  Biosynthesis of plant secondary metabolites
map01066  Biosynthesis of alkaloids derived from terpenoid and polyketide
Enzyme
1.5.1.-
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived by amination reactions
   Acetate derived alkaloids
    C06523  Coniine
Natural toxins [BR:br08009]
 Phytotoxins
  Alkaloids
   Piperidine alkaloids
    C06523  Coniine
BRITE hierarchy
Other DBs
CAS: 458-88-8
PubChem: 8754
ChEBI: 28322
ChEMBL: CHEMBL2287063
KNApSAcK: C00002031
3DMET: B02049
NIKKAJI: J5.763K
LinkDB All DBs
KCF data Show

ATOM        9
            1   C1y C    25.0600  -15.0897
            2   C1x C    25.0600  -16.4889
            3   N1x N    23.8482  -14.3872
            4   C1b C    26.2718  -14.3872
            5   C1x C    23.8482  -17.1913
            6   C1x C    22.6365  -15.0897
            7   C1b C    27.4835  -15.0897
            8   C1x C    22.6365  -16.4889
            9   C1a C    28.6953  -14.3931
BOND        9
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     5   8 1
            8     7   9 1
            9     6   8 1

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