KEGG   COMPOUND: C20166
Entry
C20166                      Compound                               
Name
Naltriben;
NTB
Formula
C26H25NO4
Exact mass
415.1784
Mol weight
415.481
Structure
Other DBs
CAS: 111555-58-9
PubChem: 163311909
ChEBI: 177440
PDB-CCD: ZY8[PDBj]
KCF data

ATOM        31
            1   C1y C    17.3479  -22.1531
            2   C8y C    17.3479  -23.4891
            3   C8y C    18.5049  -24.1570
            4   C1x C    19.6619  -23.4891
            5   C1z C    19.6619  -22.1531
            6   C1z C    18.5049  -21.4851
            7   C1y C    20.8189  -21.4851
            8   C1x C    20.8189  -20.1491
            9   C8y C    19.6619  -19.4811
            10  C8y C    18.5049  -20.1491
            11  C8x C    19.6619  -18.1451
            12  C8x C    18.5049  -17.4772
            13  C8y C    17.3479  -18.1451
            14  C8y C    17.3479  -19.4811
            15  O2x O    16.4033  -20.6930
            16  O2x O    16.3551  -24.3830
            17  C8y C    16.8985  -25.6035
            18  C8y C    18.2272  -25.4638
            19  C8x C    16.3551  -26.8239
            20  C8x C    17.1404  -27.9047
            21  C8x C    18.4690  -27.7651
            22  C8x C    19.0124  -26.5446
            23  C1x C    19.6619  -20.8172
            24  O1a O    20.8189  -22.8210
            25  N1y N    22.8442  -22.1531
            26  C1x C    21.7994  -20.8172
            27  C1b C    23.9823  -22.8210
            28  C1y C    25.1394  -22.1531
            29  O1a O    16.1910  -17.4772
            30  C1x C    26.5481  -22.1531
            31  C1x C    26.1355  -21.1570
BOND        38
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    6  10 1
            12    9  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   10  14 2
            17   14  15 1
            18    1  15 1 #Down
            19    2  16 1
            20   16  17 1
            21   17  18 1
            22    3  18 1
            23   17  19 2
            24   19  20 1
            25   20  21 2
            26   21  22 1
            27   18  22 2
            28    6  23 1 #Up
            29    5  24 1 #Up
            30    7  25 1 #Up
            31   23  26 1
            32   26  25 1
            33   25  27 1
            34   27  28 1
            35   13  29 1
            36   28  30 1
            37   28  31 1
            38   31  30 1

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