KEGG   COMPOUND: C13771
Entry
C13771                      Compound                               
Name
S9947;
2'-(Benzyloxycarbonylaminomethyl)biphenyl-2-carboxylic acid 2-(2-pyridyl)ethylamide
Formula
C29H27N3O3
Exact mass
465.2052
Mol weight
465.543
Structure
Other DBs
PubChem: 854017
ChEBI: 34965
NIKKAJI: J1.677.522C
KCF data

ATOM        35
            1   C8x C    11.9461  -23.0258
            2   C8x C    11.9461  -24.4252
            3   C8x C    13.1579  -25.1248
            4   C8x C    14.3698  -24.4252
            5   C8y C    14.3698  -23.0258
            6   C8x C    13.1579  -22.3261
            7   C1b C    15.5835  -22.3261
            8   O7a O    16.7954  -23.0258
            9   C7a C    18.0073  -22.3261
            10  N1b N    19.2192  -23.0258
            11  C1b C    20.4310  -22.3261
            12  C8y C    21.6429  -23.0258
            13  C8x C    21.6429  -24.4252
            14  C8x C    22.8548  -25.1248
            15  C8x C    24.0667  -24.4252
            16  C8x C    24.0667  -23.0258
            17  C8y C    22.8548  -22.3261
            18  C8y C    22.8548  -20.9267
            19  C8y C    24.0714  -20.2243
            20  C8x C    24.0714  -18.8249
            21  C8x C    22.8595  -18.1253
            22  C8x C    21.6429  -18.8277
            23  C8x C    21.6429  -20.2271
            24  C5a C    25.2858  -20.9267
            25  N1b N    26.4977  -20.2271
            26  C1b C    27.7095  -20.9267
            27  C1b C    28.9214  -20.2271
            28  C8y C    30.1333  -20.9267
            29  O6a O    18.0073  -20.9267
            30  O5a O    25.2852  -22.3261
            31  C8x C    30.1333  -22.3292
            32  C8x C    31.3456  -23.0291
            33  C8x C    32.5580  -22.3292
            34  C8x C    32.5580  -20.9268
            35  N5x N    31.3457  -20.2268
BOND        38
            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     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   12  17 1
            19   17  18 1
            20   18  19 2
            21   19  20 1
            22   20  21 2
            23   21  22 1
            24   22  23 2
            25   18  23 1
            26   19  24 1
            27   24  25 1
            28   25  26 1
            29   26  27 1
            30   27  28 1
            31    9  29 2
            32   24  30 2
            33   28  31 2
            34   31  32 1
            35   32  33 2
            36   33  34 1
            37   34  35 2
            38   28  35 1

» Japanese version

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

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