KEGG   COMPOUND: C15552
Entry
C15552                      Compound                               
Name
PD 123177
Formula
C29H28N4O3
Exact mass
480.2161
Mol weight
480.5576
Structure
Pathway
map07229  Angiotensin receptor and endothelin receptor antagonists
Other DBs
CAS: 114785-12-5
PubChem: 17396544
ChEBI: 79978
NIKKAJI: J386.726I
KCF data

ATOM        36
            1   C8y C    26.5650  -20.1309
            2   N4y N    26.1216  -18.8067
            3   C8y C    27.9590  -20.1366
            4   C1x C    25.8650  -21.3382
            5   C8x C    27.2590  -17.9726
            6   C1b C    24.8967  -18.1184
            7   N5x N    28.3965  -18.8067
            8   C1x C    28.6531  -21.3441
            9   C1y C    26.5590  -22.5457
            10  C8y C    23.6950  -18.8417
            11  N1y N    27.9531  -22.5516
            12  C8x C    22.4642  -18.1592
            13  C8x C    23.7241  -20.2184
            14  C8x C    21.2626  -18.8825
            15  C8y C    22.5109  -20.9650
            16  C8y C    21.2976  -20.2825
            17  N1a N    20.0773  -21.0167
            18  C1a C    22.5384  -22.4000
            19  C5a C    28.6385  -23.7475
            20  C1c C    30.0298  -23.7518
            21  O5a O    27.9401  -24.9482
            22  C8y C    30.7432  -22.5253
            23  C8y C    30.7168  -24.9500
            24  C8x C    32.1300  -22.5298
            25  C8x C    32.8339  -21.3197
            26  C8x C    32.1379  -20.1050
            27  C8x C    30.7511  -20.1004
            28  C8x C    30.0472  -21.3105
            29  C8x C    30.0294  -26.1321
            30  C8x C    30.7257  -27.3467
            31  C8x C    32.1257  -27.3510
            32  C8x C    32.8130  -26.1689
            33  C8x C    32.1168  -24.9543
            34  C6a C    25.8507  -23.7642
            35  O6a O    24.4303  -23.7605
            36  O6a O    26.5274  -24.9439
BOND        40
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     6  10 1
            10    8  11 1
            11   10  12 1
            12   10  13 2
            13   12  14 2
            14   13  15 1
            15   14  16 1
            16    5   7 2
            17    9  11 1
            18   15  16 2
            19   16  17 1
            20   15  18 1
            21   11  19 1
            22   19  20 1
            23   19  21 2
            24   20  22 1
            25   20  23 1
            26   22  24 2
            27   24  25 1
            28   25  26 2
            29   26  27 1
            30   27  28 2
            31   22  28 1
            32   23  29 2
            33   29  30 1
            34   30  31 2
            35   31  32 1
            36   32  33 2
            37   23  33 1
            38    9  34 1
            39   34  35 1
            40   34  36 2

» Japanese version

  All links  
Pathway (1)   
   KEGG PATHWAY (1)   
Chemical substance (3)   
   PubChem (1)   
   ChEBI (1)   
   NIKKAJI (1)   
All databases (4)   

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