KEGG   COMPOUND: C08439Help
Entry
C08439                      Compound                               

Name
Phalloidin;
Phalloidine
Formula
C35H48N8O11S
Exact mass
788.3163
Mol weight
788.8676
Structure
Mol fileKCF fileDB searchJmolKegDraw
Pathway
Bile secretion
Brite
Natural toxins [BR:br08009]
 Fungal toxins
  Mushroom toxins
   Cyclic peptides
    C08439  Phalloidin
BRITE hierarchy
Other DBs
CAS: 
17466-45-4
PubChem: 
ChEBI: 
KNApSAcK: 
NIKKAJI: 
KCF data Show

ATOM        55
            1   C8y C    25.9177  -19.6177
            2   C8y C    27.1891  -20.2301
            3   C8y C    24.9496  -20.6441
            4   C1x C    27.1600  -19.0578
            5   C8y C    26.9909  -21.6182
            6   C8x C    28.4897  -19.7051
            7   N4x N    25.6202  -21.8805
            8   S2x S    23.5440  -20.6441
            9   C1y C    27.1600  -17.6581
            10  C8x C    28.1048  -22.4812
            11  C8x C    29.5979  -20.5624
            12  C1x C    23.5440  -21.9798
            13  C5x C    28.3730  -16.9582
            14  N1x N    25.9468  -16.9640
            15  C8x C    29.4054  -21.9505
            16  C1y C    24.7572  -22.9770
            17  N1x N    29.5803  -17.6522
            18  O5x O    28.3614  -15.5527
            19  C5x C    24.7338  -17.6698
            20  C5x C    23.4041  -22.9653
            21  N1x N    25.9177  -23.6535
            22  C1y C    30.7526  -18.3170
            23  C1y C    23.5208  -16.9699
            24  O5x O    24.7279  -19.0695
            25  N1y N    21.0479  -21.1808
            26  O5x O    22.7276  -24.1318
            27  C5x C    27.0842  -22.9770
            28  C5x C    31.4174  -19.4835
            29  C1b C    31.9132  -17.6407
            30  N1x N    22.3076  -17.6755
            31  C1a C    23.5208  -15.5761
            32  C1y C    21.1003  -19.7694
            33  C1x C    19.7882  -21.6239
            34  C1y C    28.2448  -23.6535
            35  O5x O    27.0726  -24.3184
            36  N1x N    30.7526  -20.6500
            37  O5x O    32.5780  -19.4543
            38  C1d C    33.0797  -18.3113
            39  C5x C    22.3076  -19.0695
            40  C1x C    19.7589  -19.3552
            41  C1y C    18.9425  -20.5100
            42  N1x N    29.4054  -22.9770
            43  C1c C    28.2448  -24.9891
            44  C1y C    31.4234  -21.8106
            45  C1b C    34.2403  -17.6347
            46  C1a C    33.7738  -20.2127
            47  O1a O    34.4503  -19.1861
            48  O5x O    23.5208  -19.7694
            49  O1a O    17.5369  -20.4983
            50  C5x C    30.7526  -22.9770
            51  C1a C    27.0842  -25.6598
            52  O1a O    29.4054  -25.6657
            53  C1a C    32.7238  -22.1546
            54  O1a O    35.4066  -18.2996
            55  O5x O    31.4174  -24.1376
BOND        59
            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
            9     5  10 1
            10    6  11 2
            11    8  12 1
            12    9  13 1
            13    9  14 1
            14   10  15 2
            15   12  16 1
            16   13  17 1
            17   13  18 2
            18   14  19 1
            19   16  20 1
            20   16  21 1
            21   17  22 1
            22   19  23 1
            23   19  24 2
            24   20  25 1
            25   20  26 2
            26   21  27 1
            27   22  28 1
            28   22  29 1 #Up
            29   23  30 1
            30   23  31 1 #Up
            31   25  32 1
            32   25  33 1
            33   27  34 1
            34   27  35 2
            35   28  36 1
            36   28  37 2
            37   29  38 1
            38   30  39 1
            39   32  40 1
            40   33  41 1
            41   34  42 1
            42   34  43 1
            43   36  44 1
            44   38  45 1
            45   38  46 1 #Up
            46   38  47 1 #Down
            47   39  48 2
            48   41  49 1 #Up
            49   42  50 1
            50   43  51 1
            51   43  52 1 #Up
            52   44  53 1 #Up
            53   45  54 1
            54   50  55 2
            55    5   7 1
            56   11  15 1
            57   32  39 1
            58   40  41 1
            59   44  50 1

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