KEGG   DRUG: Axitirome
Entry
D03018                      Drug                                   
Name
Axitirome (USAN/INN)
Formula
C25H24FNO6
Exact mass
453.1588
Mol weight
453.46
Structure
Efficacy
Antihyperlipidemic
Comment
Thyroid hormone mimetic
Hypolipidemic
Other DBs
CAS: 156740-57-7
PubChem: 17397174
LigandBox: D03018
LinkDB
KCF data

ATOM        33
            1   C8y C    30.2400  -23.5200
            2   C8x C    30.2400  -22.1200
            3   C8x C    31.4300  -21.4200
            4   C8y C    32.6200  -22.1200
            5   C8x C    32.6200  -23.5200
            6   C8x C    31.4300  -24.2200
            7   X   F    33.8800  -21.4200
            8   C1c C    28.9800  -24.2200
            9   C8y C    27.7900  -23.5200
            10  O1a O    28.9800  -25.6200
            11  C8x C    26.6000  -24.2200
            12  C8y C    25.4100  -23.5200
            13  C8x C    25.4100  -22.1200
            14  C8x C    26.6000  -21.4200
            15  C8y C    27.7900  -22.1200
            16  O1a O    29.0500  -21.4200
            17  O2a O    24.1500  -24.2200
            18  C8y C    22.9600  -23.5200
            19  C8y C    21.7700  -24.2200
            20  C8x C    20.5800  -23.5200
            21  C8y C    20.5800  -22.1200
            22  C8x C    21.7700  -21.4200
            23  C8y C    22.9600  -22.1200
            24  C1a C    24.2200  -21.4200
            25  C1a C    21.7700  -25.6200
            26  N1b N    19.3200  -21.4200
            27  C5a C    18.1300  -22.1200
            28  C7a C    16.9400  -21.4200
            29  O5a O    18.1300  -23.5200
            30  O7a O    15.7500  -22.1200
            31  O6a O    16.9400  -20.0200
            32  C1b C    14.5600  -21.4200
            33  C1a C    13.3700  -22.1200
BOND        35
            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     4   7 1
            8     1   8 1
            9     8   9 1
            10    8  10 1
            11    9  11 2
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16    9  15 1
            17   15  16 1
            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   23  24 1
            27   19  25 1
            28   21  26 1
            29   26  27 1
            30   27  28 1
            31   27  29 2
            32   28  30 1
            33   28  31 2
            34   30  32 1
            35   32  33 1

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