| Entry |
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| Name |
Gonadorelin hydrochloride (USP);
Factrel (TN) |
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| Formula |
C55H75N17O13. xHCl
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| Structure |
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| Simcomp |
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| Class |
Hormonal agent
DG01494 Gonadotropin-releasing hormone receptor agonist
|
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| Remark |
| Product (DG00499): | D03267<JP> |
|
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| Efficacy |
Gonadotropin-releasing hormone receptor agonist |
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| Comment |
synthetic gonadotropin-releasing hormone
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| Target |
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| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
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| Interaction |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
H01 PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
H01C HYPOTHALAMIC HORMONES
H01CA Gonadotropin-releasing hormones
H01CA01 Gonadorelin
D00988 Gonadorelin hydrochloride (USP)
V VARIOUS
V04 DIAGNOSTIC AGENTS
V04C OTHER DIAGNOSTIC AGENTS
V04CM Tests for fertility disturbances
V04CM01 Gonadorelin
D00988 Gonadorelin hydrochloride (USP)
Drug groups [BR:br08330]
Hormonal agent
DG01494 Gonadotropin-releasing hormone receptor agonist
DG00499 Gonadorelin
D00988 Gonadorelin hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Gonadotropin-releasing hormone
GNRHR
D00988 Gonadorelin hydrochloride (USP)
Drug groups [BR:br08330]
Hormonal agent
DG01494 Gonadotropin-releasing hormone receptor agonist
DG00499 Gonadorelin
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| Other DBs |
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| KCF data |
ATOM 86
1 X Cl 33.0404 -12.9694
2 C8y C 12.8828 -12.9335
3 C8y C 12.4420 -14.2464
4 C8y C 14.2706 -12.9335
5 C8x C 12.1983 -11.7052
6 C1b C 11.2512 -14.9308
7 C8x C 13.5671 -15.0714
8 N4x N 14.6924 -14.2651
9 C8x C 14.9831 -11.7427
10 C8x C 12.9016 -10.5050
11 C1c C 11.2607 -16.3185
12 C8x C 14.2986 -10.5238
13 N1b N 10.0509 -17.0124
14 C5a C 12.4515 -17.0029
15 C5a C 8.8602 -16.3280
16 N1b N 13.6422 -16.3185
17 O5a O 12.4515 -18.3908
18 C1c C 7.6694 -17.0217
19 O5a O 8.8602 -14.9401
20 C1c C 14.8332 -16.9937
21 C1b C 7.6694 -18.4001
22 N1b N 6.4691 -16.3372
23 C5a C 16.0428 -16.3092
24 C1b C 14.8425 -18.3813
25 C8y C 8.8697 -19.0847
26 C5a C 5.2689 -17.0312
27 N1b N 17.2243 -16.9844
28 O5a O 16.0428 -14.9213
29 O1a O 16.0428 -19.0659
30 C8x C 10.1719 -18.6284
31 N4x N 8.9158 -20.4774
32 C1y C 4.0874 -16.3372
33 O5a O 5.2689 -18.4188
34 C1c C 18.4246 -16.2997
35 N5x N 11.0274 -19.7120
36 C8x C 10.2419 -20.8702
37 N1x N 4.0641 -14.9619
38 C1x C 2.7788 -16.7637
39 C1b C 18.4246 -14.9120
40 C5a C 19.6341 -16.9844
41 C5x C 2.7670 -14.5570
42 C1x C 1.9751 -15.6736
43 C8y C 19.6341 -14.2088
44 N1b N 20.8155 -16.2809
45 O5a O 19.6341 -18.3625
46 O5x O 2.3264 -13.2305
47 C8x C 20.8155 -14.9120
48 C8x C 19.6153 -12.8209
49 C1b C 22.0155 -16.9749
50 C8x C 22.0155 -14.2088
51 C8x C 20.8060 -12.1365
52 C5a C 23.2066 -16.2809
53 C8y C 22.0155 -12.8209
54 N1b N 24.4070 -16.9656
55 O5a O 23.2066 -14.9025
56 O1a O 23.2066 -12.1270
57 C1c C 25.5977 -16.2809
58 C5a C 26.8073 -16.9469
59 C1b C 25.5977 -14.8933
60 N1b N 28.0075 -16.2717
61 O5a O 26.8073 -18.3440
62 C1c C 26.8073 -14.1901
63 C1c C 29.1890 -16.9469
64 C1a C 26.7980 -12.8022
65 C1a C 28.0075 -14.8933
66 C5a C 30.3893 -16.2622
67 C1b C 29.1890 -18.3440
68 N1y N 31.5238 -16.9469
69 O5a O 30.3893 -14.8838
70 C1b C 28.0075 -19.0190
71 C1y C 32.9114 -16.9094
72 C1x C 31.1300 -18.2690
73 C1b C 28.0075 -20.4068
74 C1x C 33.3710 -18.2127
75 C5a C 34.1117 -16.2154
76 C1x C 32.2645 -19.0565
77 N1b N 26.7980 -21.1005
78 N1b N 35.3027 -16.9094
79 O5a O 34.1117 -14.8275
80 C2c C 25.5882 -20.4068
81 N1a N 25.5882 -19.0097
82 N2a N 24.3787 -21.1005
83 C1b C 36.4886 -16.2335
84 C5a C 37.6860 -16.9338
85 N1a N 38.8800 -16.2533
86 O5a O 37.6782 -18.3399
BOND 90
1 2 3 1
2 2 4 2
3 2 5 1
4 3 6 1
5 3 7 2
6 4 8 1
7 4 9 1
8 5 10 2
9 11 6 1 #Up
10 9 12 2
11 11 13 1
12 11 14 1
13 13 15 1
14 14 16 1
15 14 17 2
16 15 18 1
17 15 19 2
18 16 20 1
19 18 21 1 #Down
20 18 22 1
21 20 23 1
22 20 24 1 #Down
23 21 25 1
24 22 26 1
25 23 27 1
26 23 28 2
27 24 29 1
28 25 30 2
29 25 31 1
30 32 26 1 #Down
31 26 33 2
32 27 34 1
33 30 35 1
34 31 36 1
35 32 37 1
36 32 38 1
37 34 39 1 #Up
38 34 40 1
39 37 41 1
40 38 42 1
41 39 43 1
42 40 44 1
43 40 45 2
44 41 46 2
45 43 47 2
46 43 48 1
47 44 49 1
48 47 50 1
49 48 51 2
50 49 52 1
51 50 53 2
52 52 54 1
53 52 55 2
54 53 56 1
55 54 57 1
56 57 58 1
57 57 59 1 #Up
58 58 60 1
59 58 61 2
60 59 62 1
61 60 63 1
62 62 64 1
63 62 65 1
64 63 66 1
65 63 67 1 #Down
66 66 68 1
67 66 69 2
68 67 70 1
69 68 71 1
70 68 72 1
71 70 73 1
72 71 74 1
73 71 75 1 #Down
74 72 76 1
75 73 77 1
76 75 78 1
77 75 79 2
78 77 80 1
79 80 81 1
80 80 82 2
81 7 8 1
82 10 12 1
83 35 36 2
84 41 42 1
85 51 53 1
86 74 76 1
87 78 83 1
88 83 84 1
89 84 85 1
90 84 86 2
BRACKET 1 31.5700 -13.8600 31.5700 -12.0400
1 33.8100 -12.0400 33.8100 -13.8600
1 x
ORIGINAL 1 1
REPEAT 1
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