| Entry |
|
|---|
| Name |
Sitagliptin (USAN/INN) |
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| Product |
|
|---|
| Generic |
|
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| Formula |
C16H15F6N5O
|
|---|
| Exact mass |
407.1181
|
|---|
| Mol weight |
407.31
|
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| Structure |
|
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| Simcomp |
|
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| Class |
|
|---|
| Remark |
| Product (DG00118): | D08516<US> D06645<JP/US> |
| Product (mixture): | D10261<US> D11064<JP> D11066<US> |
|
|---|
| Efficacy |
Antidiabetic, Dipeptidyl peptidase-4 (DPP-4) inhibitor |
|---|
| Comment |
Treatment of type 2 diabetes mellitus and related disorders
|
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| Target |
|
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| Pathway |
| hsa04974 | Protein digestion and absorption |
|
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| Interaction |
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| Structure map |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A10 DRUGS USED IN DIABETES
A10B BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
A10BH Dipeptidyl peptidase 4 (DPP-4) inhibitors
A10BH01 Sitagliptin
D08516 Sitagliptin (USAN/INN) <US>
Drug groups [BR:br08330]
Antidiabetic agent
DG02044 Hypoglycemic agent
DG01601 DPP-4 inhibitor
DG00118 Sitagliptin
D08516 Sitagliptin
Drug classes [BR:br08332]
Antidiabetic agent
DG01601 DPP-4 inhibitor
D08516 Sitagliptin
DG02044 Hypoglycemic agent
D08516 Sitagliptin
Target-based classification of drugs [BR:br08310]
Peptidases and inhibitors
Serine peptidases
Prolyl oligopeptidase family
DPP4 (CD26)
D08516 Sitagliptin (USAN/INN) <US>
Drug groups [BR:br08330]
Antidiabetic agent
DG02044 Hypoglycemic agent
DG01601 DPP-4 inhibitor
DG00118 Sitagliptin
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 28
1 C8y C 17.9900 -15.6100
2 C8x C 17.9900 -17.0100
3 C8y C 19.1800 -17.7100
4 C8y C 20.4400 -17.0100
5 C8x C 20.4400 -15.6100
6 C8y C 19.1800 -14.9100
7 X F 19.1800 -13.5100
8 X F 19.1800 -19.1100
9 X F 16.8000 -14.9100
10 C1b C 21.6300 -17.7100
11 C1c C 22.8900 -17.0100
12 C1b C 24.0100 -17.7100
13 C5a C 25.2000 -17.0100
14 N1y N 26.3900 -17.7100
15 O5a O 25.2000 -15.6100
16 N1a N 22.8900 -15.6100
17 C1x C 26.3900 -19.1100
18 C1x C 27.6500 -19.8100
19 N4y N 28.8400 -19.1100
20 C8y C 28.8400 -17.7100
21 C1x C 27.6500 -17.0100
22 C8y C 30.1700 -19.5300
23 N5x N 31.0100 -18.4100
24 N5x N 30.1700 -17.2900
25 C1d C 30.1700 -20.9300
26 X F 30.1700 -22.3300
27 X F 31.5700 -20.9300
28 X F 28.7700 -20.9300
BOND 30
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 6 7 1
8 3 8 1
9 1 9 1
10 4 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 13 15 2
16 11 16 1 #Up
17 14 17 1
18 17 18 1
19 18 19 1
20 19 20 1
21 20 21 1
22 14 21 1
23 19 22 1
24 22 23 2
25 23 24 1
26 20 24 2
27 22 25 1
28 25 26 1
29 25 27 1
30 25 28 1
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