KEGG   COMPOUND: C09624
Entry
C09624                      Compound                               
Name
Rodiasine
Formula
C38H42N2O6
Exact mass
622.3043
Mol weight
622.7499
Structure
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C09624  Rodiasine
Other DBs
CAS: 6391-64-6
PubChem: 11814
ChEBI: 8886
KNApSAcK: C00001912
3DMET: B03139
NIKKAJI: J37.157B
LinkDB
KCF data

ATOM        46
            1   C8y C    27.2929  -13.8966
            2   C8y C    28.4432  -14.5708
            3   C8y C    27.2988  -12.5642
            4   C1y C    26.1356  -14.5649
            5   C8y C    29.6064  -13.8966
            6   O2x O    28.4303  -17.7325
            7   C8x C    28.4432  -11.8898
            8   C1x C    26.1473  -11.8839
            9   C1x C    26.1297  -15.8963
            10  N1y N    24.9782  -13.8849
            11  C8y C    29.6064  -12.5642
            12  O2a O    30.7636  -14.5708
            13  C8y C    29.5528  -18.3381
            14  C1x C    25.0074  -12.5642
            15  C8y C    24.9724  -16.5529
            16  C1a C    23.8280  -14.5358
            17  O2a O    30.7636  -11.8898
            18  C1a C    31.8965  -13.8966
            19  C8x C    29.5469  -19.6750
            20  C8y C    30.6750  -17.6110
            21  C8x C    24.9724  -17.8842
            22  C8x C    23.8280  -15.8787
            23  C1a C    31.9082  -12.5526
            24  C8y C    30.8080  -20.2793
            25  C8x C    31.8604  -18.2213
            26  O2a O    30.6751  -16.2741
            27  C8y C    23.8163  -18.5468
            28  C8x C    22.6648  -16.5412
            29  C8y C    31.8545  -19.5466
            30  C1y C    30.8080  -21.6046
            31  C1a C    31.9374  -15.5589
            32  C8y C    22.6589  -17.8783
            33  C1x C    33.1169  -20.1464
            34  C1x C    27.4456  -22.4074
            35  N1y N    32.0762  -22.2103
            36  C8y C    22.6624  -20.5243
            37  O2a O    21.5074  -18.5292
            38  C1x C    33.0982  -21.4659
            39  C8y C    25.0062  -21.8030
            40  C1a C    32.0746  -23.5296
            41  C8y C    23.8080  -19.8325
            42  C8x C    22.6915  -21.8612
            43  C8x C    24.9829  -20.4661
            44  C8x C    23.8664  -22.5006
            45  O1a O    21.4674  -19.8660
            46  C1a C    20.2979  -17.8160
BOND        52
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1 #Down
            9     4  10 1
            10    5  11 1
            11    5  12 1
            12    6  13 1
            13    8  14 1
            14    9  15 1
            15   10  16 1
            16   11  17 1
            17   12  18 1
            18   13  19 2
            19   13  20 1
            20   15  21 1
            21   15  22 2
            22   17  23 1
            23   19  24 1
            24   20  25 2
            25   20  26 1
            26   21  27 2
            27   22  28 1
            28   24  29 2
            29   24  30 1
            30   26  31 1
            31   27  32 1
            32   29  33 1
            33   30  34 1 #Down
            34   30  35 1
            35   32  37 1
            36   33  38 1
            37   34  39 1
            38   35  40 1
            39   36  41 2
            40   36  42 1
            41   39  43 2
            42   39  44 1
            43    7  11 2
            44   10  14 1
            45   25  29 1
            46   28  32 2
            47   35  38 1
            48   41  43 1
            49   42  44 2
            50   36  45 1
            51   27  41 1
            52   37  46 1

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