KEGG   COMPOUND: C08657
Entry
C08657                      Compound                               
Name
Anhwiedelphinine
Formula
C35H44N2O10
Exact mass
652.2996
Mol weight
652.7313
Structure
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived by amination reactions
   Terpenoid alkaloids
    C08657  Anhwiedelphinine
Other DBs
CAS: 102503-60-6
PubChem: 10850
ChEBI: 2726
KNApSAcK: C00001613
3DMET: B02307
NIKKAJI: J492.836I
LinkDB
KCF data

ATOM        47
            1   C1z C    26.9618  -15.8076
            2   C1y C    26.9618  -17.1555
            3   C1y C    27.9247  -15.0372
            4   C1y C    26.8801  -14.3371
            5   C1y C    25.8122  -15.1481
            6   C1z C    25.8122  -17.8150
            7   C1y C    27.9713  -17.9492
            8   C1y C    29.1618  -15.3232
            9   C1x C    27.8137  -13.7768
            10  C1z C    29.2319  -17.6398
            11  N2x N    25.2579  -16.5660
            12  C1x C    24.6510  -15.8076
            13  O2a O    25.8122  -13.8059
            14  C2x C    25.2636  -18.9703
            15  C1x C    24.6510  -17.1497
            16  C1b C    26.3257  -18.9703
            17  O2a O    27.6795  -19.2504
            18  C1z C    29.7570  -16.4202
            19  C1y C    29.8096  -14.2378
            20  C1y C    28.9692  -13.2865
            21  O1a O    30.0196  -18.7136
            22  C1a C    24.6567  -13.1407
            23  O7a O    26.3199  -20.3067
            24  C1a C    28.8815  -20.1491
            25  C1x C    31.3210  -15.7025
            26  O1a O    30.9125  -17.0854
            27  O2a O    32.0737  -13.1056
            28  C1y C    30.2296  -13.2808
            29  C7a C    25.2869  -20.8961
            30  C1a C    33.1649  -13.7301
            31  O2a O    31.0291  -12.2070
            32  C8y C    25.2812  -22.0924
            33  O6a O    24.4641  -20.2950
            34  C1a C    30.2180  -10.7774
            35  C8y C    24.2482  -22.6759
            36  C8x C    26.3023  -22.6876
            37  N1y N    23.2212  -22.0748
            38  C8x C    24.2365  -23.8605
            39  C8x C    26.2966  -23.8779
            40  C5x C    22.8769  -20.9252
            41  C5x C    22.2408  -22.7460
            42  C8x C    25.2636  -24.4733
            43  C1x C    21.6923  -20.9078
            44  O5x O    23.5363  -19.9040
            45  C1y C    21.2955  -22.0281
            46  O5x O    22.2817  -23.9363
            47  C1a C    20.1576  -22.3725
BOND        54
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     1   5 1
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9    10   4 1 #Down
            10    4  11 1
            11    5  12 1
            12    5  13 1 #Down
            13    6  14 1 #Down
            14    6  15 1
            15    6  16 1 #Up
            16    7  17 1 #Up
            17    8  18 1
            18    8  19 1
            19    9  20 1
            20   10  21 1
            21   13  22 1
            22   16  23 1
            23   17  24 1
            24   18  25 1
            25   18  26 1 #Up
            26   19  27 1 #Down
            27   20  28 1
            28   23  29 1
            29   27  30 1
            30   28  31 1 #Up
            31   29  32 1
            32   29  33 2
            33   31  34 1
            34   32  35 2
            35   32  36 1
            36   35  37 1
            37   35  38 1
            38   36  39 2
            39   37  40 1
            40   37  41 1
            41   38  42 2
            42   40  43 1
            43   40  44 2
            44   41  45 1
            45   41  46 2
            46   45  47 1 #Up
            47    7  10 1
            48   10  18 1
            49   11  14 2
            50   12  15 1
            51   19  20 1
            52   25  28 1
            53   39  42 1
            54   43  45 1

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