| Entry |
|
|---|
| Name |
Risarestat (INN);
CT 112 |
|---|
| Formula |
C16H21NO4S
|
|---|
| Exact mass |
323.1191
|
|---|
| Mol weight |
323.41
|
|---|
| Structure |
|
|---|
| Class |
Antidiabetic agent
DG01882 Aldose reductase inhibitor
|
|---|
| Efficacy |
Hypoglycemic, Aldose reductase inhibitor |
|---|
| Target |
|
|---|
| Pathway |
| hsa00051 | Fructose and mannose metabolism |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antidiabetic agent
DG01882 Aldose reductase inhibitor
D01715 Risarestat
Target-based classification of drugs [BR:br08310]
Enzymes
Oxidoreductases (EC1)
Dehydrogenases
AKR1B1
D01715 Risarestat (INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 22
1 C5x C 21.6901 -20.4728
2 C1y C 22.1230 -19.1511
3 S2x S 20.9949 -18.3308
4 C5x C 19.8669 -19.1511
5 N1x N 20.2997 -20.4728
6 C8y C 25.7702 -18.4555
7 C8y C 25.7702 -17.0374
8 C8x C 24.5555 -19.1589
9 O2a O 26.9965 -16.3342
10 C8x C 24.5555 -16.3342
11 C8y C 23.3293 -18.4555
12 C1b C 28.2229 -17.0374
13 C8x C 23.3293 -17.0374
14 C1b C 29.4376 -16.3401
15 C1b C 30.6640 -17.0434
16 O2a O 26.9749 -19.1499
17 C1b C 28.1787 -18.4539
18 C1a C 29.3832 -19.1486
19 C1b C 31.8662 -16.3445
20 C1a C 33.0725 -17.0363
21 O5x O 18.5439 -18.7233
22 O5x O 22.5060 -21.5989
BOND 23
1 5 1 1
2 10 13 1
3 12 14 1
4 14 15 1
5 11 13 2
6 6 16 1
7 16 17 1
8 6 7 1
9 6 8 2
10 7 9 1
11 7 10 2
12 8 11 1
13 9 12 1
14 17 18 1
15 1 2 1
16 15 19 1
17 2 3 1
18 19 20 1
19 2 11 1
20 3 4 1
21 4 21 2
22 4 5 1
23 1 22 2
|
|---|
