KEGG   COMPOUND: C06163
Entry
C06163                      Compound                               

Name
(S)-cis-N-Methylstylopine
Formula
C20H20NO4
Exact mass
338.1392
Mol weight
338.3771
Structure
Reaction
Pathway
map00950  Isoquinoline alkaloid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.14.97      2.1.1.122
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C06163  (S)-cis-N-methylstylopine
Other DBs
PubChem: 8419
ChEBI: 444
KNApSAcK: C00026083 C00026110
PDB-CCD: SYT[PDBj]
3DMET: B05170
NIKKAJI: J1.767.334C
KCF data

ATOM        25
            1   C8y C    12.8800  -13.7900
            2   C8y C    12.8800  -15.1900
            3   C8x C    14.0700  -15.8900
            4   C8y C    15.3300  -15.1900
            5   C8y C    15.3300  -13.7900
            6   C8x C    14.0700  -13.0900
            7   O2x O    11.5500  -13.3700
            8   C1x C    10.7100  -14.4900
            9   O2x O    11.5500  -15.6100
            10  C1x C    16.5200  -15.8900
            11  C1x C    17.7100  -15.1900
            12  N2y N    17.7100  -13.7900 #+
            13  C1y C    16.5200  -13.0900
            14  C1x C    18.9700  -13.0900
            15  C8y C    18.9700  -11.6900
            16  C8y C    17.7100  -10.9900
            17  C1x C    16.5200  -11.6900
            18  C1a C    18.9700  -14.4900
            19  C8y C    20.1600  -10.9900
            20  C8y C    20.1600   -9.5900
            21  C8x C    18.9700   -8.8900
            22  C8x C    17.7100   -9.5900
            23  O2x O    21.4900  -11.4100
            24  C1x C    22.3300  -10.2900
            25  O2x O    21.4900   -9.1700
BOND        30
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     8   9 1
            10    2   9 1
            11    4  10 1
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15    5  13 1
            16   12  14 1
            17   14  15 1
            18   15  16 2
            19   16  17 1
            20   13  17 1
            21   12  18 1 #Up
            22   15  19 1
            23   19  20 2
            24   20  21 1
            25   21  22 2
            26   16  22 1
            27   19  23 1
            28   23  24 1
            29   24  25 1
            30   20  25 1

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