Entry |
|
Name |
Turofexorate isopropyl (USAN/INN) |
Formula |
C25H24F2N2O3
|
Exact mass |
438.1755
|
Mol weight |
438.47
|
Structure |

|
Efficacy |
Antidyslipidemia, Farnesoid X receptor (FXR) agonist |
Comment |
Treatment of lipid disorders including hypertriglyceridemia and hypercholesterolemia
|
Target |
|
Brite |
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Thyroid hormone like receptors
Liver X receptor like receptor
NR1H4 (FXR)
D08277 Turofexorate isopropyl (USAN/INN)
|
Other DBs |
|
KCF data |
ATOM 32
1 C2x C 22.2600 -21.7700
2 C2y C 23.5200 -21.2100
3 C8y C 24.7800 -21.8400
4 C8y C 25.0600 -23.1700
5 N1y N 21.9100 -23.1700
6 C1z C 24.2200 -24.2900
7 C1x C 22.8200 -24.2900
8 C7a C 23.5200 -19.8100
9 O7a O 24.7800 -19.1100
10 O6a O 22.3300 -19.1100
11 C1c C 24.7800 -17.7100
12 C1a C 25.9700 -17.0100
13 C1a C 23.5900 -17.0100
14 C8y C 19.5300 -23.1700
15 C5a C 20.7200 -23.8700
16 O5a O 20.7200 -25.2700
17 C8x C 19.5414 -21.7700
18 C8x C 18.3347 -21.0602
19 C8y C 17.1166 -21.7503
20 C8y C 17.1752 -23.1503
21 C8x C 18.3119 -23.8601
22 X F 15.9264 -21.0897
23 X F 15.9379 -23.8705
24 C8y C 26.4114 -23.3147
25 C8y C 26.9667 -22.0741
26 N4x N 25.9584 -21.1627
27 C8x C 27.2321 -24.4489
28 C8x C 28.6247 -24.3053
29 C8x C 29.1800 -23.0647
30 C8x C 28.3593 -21.9305
31 C1a C 24.8461 -25.5422
32 C1a C 23.6462 -25.5670
BOND 35
1 3 4 2
2 1 5 1
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 2
7 6 7 1
8 2 8 1
9 8 9 1
10 8 10 2
11 9 11 1
12 11 12 1
13 11 13 1
14 14 15 1
15 15 5 1
16 15 16 2
17 14 17 2
18 17 18 1
19 18 19 2
20 19 20 1
21 20 21 2
22 14 21 1
23 19 22 1
24 20 23 1
25 4 24 1
26 24 25 1
27 25 26 1
28 3 26 1
29 24 27 2
30 27 28 1
31 28 29 2
32 29 30 1
33 25 30 2
34 6 31 1
35 6 32 1
|