KEGG   COMPOUND: C19980
Entry
C19980                      Compound                               
Name
Domesticine
Formula
C19H19NO4
Exact mass
325.1314
Mol weight
325.3585
Structure
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C19980  Domesticine
Natural toxins [BR:br08009]
 Phytotoxins
  Alkaloids
   Isoquinoline alkaloids
    C19980  Domesticine
Other DBs
CAS: 476-71-1
PubChem: 135626446
ChEBI: 178226
KNApSAcK: C00028217
KCF data

ATOM        24
            1   C8y C    13.9300  -16.9400
            2   C8y C    13.9300  -18.3400
            3   C8x C    15.1424  -19.0400
            4   C8y C    16.3549  -18.3400
            5   C8y C    16.3549  -16.9400
            6   C8x C    15.1424  -16.2400
            7   C1x C    17.5673  -19.0400
            8   C1y C    18.7797  -18.3400
            9   C8y C    18.7797  -16.9400
            10  C8y C    17.5673  -16.2400
            11  N1y N    19.9922  -19.0400
            12  C1x C    21.2046  -18.3400
            13  C1x C    21.2046  -16.9400
            14  C8y C    19.9922  -16.2400
            15  C8x C    19.9922  -14.8400
            16  C8y C    18.7797  -14.1400
            17  C8y C    17.5673  -14.8400
            18  O1a O    16.3569  -14.1412
            19  O2a O    18.7797  -12.7401
            20  C1a C    17.5525  -12.0315
            21  C1a C    19.9922  -20.4397
            22  O2x O    12.5985  -16.5074
            23  C1x C    11.7756  -17.6400
            24  O2x O    12.5985  -18.7726
BOND        28
            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     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    8  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    9  14 1
            17   14  15 2
            18   15  16 1
            19   16  17 2
            20   10  17 1
            21   17  18 1
            22   16  19 1
            23   19  20 1
            24   11  21 1
            25    1  22 1
            26   22  23 1
            27   23  24 1
            28    2  24 1

» Japanese version

  All links  
Chemical substance (3)   
   PubChem (1)   
   ChEBI (1)   
   KNApSAcK (1)   
All databases (3)   

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