KEGG   COMPOUND: C05174Help
Entry
C05174                      Compound                               

Name
(S)-Cheilanthifoline;
(6aS)-6,6a,11,14-Tetrahydro-8-methoxy-12H-benzo[a]-1,3-benzodioxolo[4,5-g]quinolizim-9-ol
Formula
C19H19NO4
Exact mass
325.1314
Mol weight
325.3585
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Isoquinoline alkaloid biosynthesis
Metabolic pathways
Biosynthesis of secondary metabolites
Enzyme
1.14.21.1       1.14.21.2
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C05174  (S)-Cheilanthifoline
BRITE hierarchy
Other DBs
CAS: 
483-44-3
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C1y C    26.6877  -21.2564
            2   C8y C    25.3821  -21.9151
            3   N1y N    27.8125  -21.9791
            4   C1x C    26.6467  -19.8576
            5   C8y C    25.4112  -23.3196
            6   C8x C    24.1873  -21.1747
            7   C1x C    29.0364  -21.3088
            8   C1x C    27.7775  -23.3837
            9   C8y C    27.9465  -19.1874
            10  C1x C    26.5419  -24.0540
            11  C8x C    24.0997  -23.9898
            12  C8y C    22.9516  -21.8334
            13  C8y C    29.0656  -19.9101
            14  C8x C    27.8999  -17.8002
            15  C8y C    22.9751  -23.2497
            16  O1a O    21.7510  -21.0933
            17  C8y C    30.2837  -19.2398
            18  C8x C    29.1239  -17.1241
            19  O2a O    21.6577  -23.9141
            20  C8y C    30.3128  -17.8410
            21  O2x O    31.6067  -19.6944
            22  C1a C    20.4746  -23.1797
            23  O2x O    31.6476  -17.4329
            24  C1x C    32.4460  -18.5811
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 2
            11    6  12 1
            12    7  13 1
            13    9  14 1
            14   11  15 1
            15   12  16 1
            16   13  17 1
            17   14  18 2
            18   15  19 1
            19   17  20 2
            20   17  21 1
            21   19  22 1
            22   20  23 1
            23   21  24 1
            24    8  10 1
            25    9  13 2
            26   12  15 2
            27   18  20 1
            28   23  24 1

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