| Entry |
|
|---|
| Name |
Simfibrate (JAN/INN);
Cholesolvin (TN) |
|---|
| Formula |
C23H26Cl2O6
|
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| Exact mass |
468.1106
|
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| Mol weight |
469.3549
|
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| Structure |
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| Simcomp |
|
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| Class |
|
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| Remark |
|
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| Efficacy |
Antihyperlipidemic |
|---|
| Comment |
Clofibrate derivative
|
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| Interaction |
|
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| Structure map |
| map07222 | Peroxisome proliferator-activated receptor (PPAR) agonists |
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C10 LIPID MODIFYING AGENTS
C10A LIPID MODIFYING AGENTS, PLAIN
C10AB Fibrates
C10AB06 Simfibrate
D01212 Simfibrate (JAN/INN)
Drug groups [BR:br08330]
Hypolipidemic agent
DG01946 Hypolipidemic agent
DG01733 PPAR alpha agonist
DG01547 Fibrate
D01212 Simfibrate
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 31
1 C8x C 13.9201 -17.1683
2 C8y C 13.9201 -18.5684
3 C8x C 15.1356 -19.2684
4 C8x C 16.3439 -18.5684
5 C8y C 16.3439 -17.1683
6 C8x C 15.1356 -16.4682
7 X Cl 12.7081 -19.2691
8 O2a O 17.5570 -16.4691
9 C1d C 18.7690 -17.1701
10 C7a C 19.9821 -16.4709
11 C1a C 17.7669 -18.1582
12 C1a C 19.7539 -18.1582
13 O7a O 21.1940 -17.1718
14 O6a O 19.9831 -15.0708
15 C1b C 22.4071 -16.4728
16 C1b C 23.6191 -17.1737
17 C1b C 24.8320 -16.4745
18 O7a O 26.0441 -17.1756
19 C7a C 27.2572 -16.4764
20 C1d C 28.4691 -17.1773
21 O2a O 29.6821 -16.4782
22 C1a C 27.4686 -18.1653
23 C1a C 29.4556 -18.1653
24 C8y C 30.8942 -17.1791
25 C8x C 30.8896 -18.5750
26 C8x C 32.1017 -19.2761
27 C8y C 33.3147 -18.5769
28 C8x C 33.3158 -17.1768
29 C8x C 32.1037 -16.4759
30 X Cl 34.5266 -19.2777
31 O6a O 27.2582 -15.0763
BOND 32
1 1 2 2
2 15 16 1
3 5 8 1
4 16 17 1
5 2 3 1
6 17 18 1
7 8 9 1
8 18 19 1
9 3 4 2
10 19 20 1
11 9 10 1
12 20 21 1
13 4 5 1
14 20 22 1
15 9 11 1
16 20 23 1
17 5 6 2
18 21 24 1
19 9 12 1
20 6 1 1
21 10 13 1
22 10 14 2
23 24 25 2
24 25 26 1
25 26 27 2
26 27 28 1
27 28 29 2
28 29 24 1
29 2 7 1
30 27 30 1
31 13 15 1
32 19 31 2
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