| Entry |
|
|---|
| Name |
Gonadorelin (INN);
Fertagyl (TN) |
|---|
| Formula |
C55H75N17O13
|
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| Exact mass |
1181.573
|
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| Mol weight |
1182.2901
|
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| Structure |
|
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| Simcomp |
|
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| Sequence |
Glp His Trp Ser Tyr Gly Leu Arg Pro Gly |
|---|
| Type |
Peptide |
|---|
| 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 |
|---|
| Comment |
Hypothalamic hormone, luteinizing hormone 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
D08027 Gonadorelin (INN)
V VARIOUS
V04 DIAGNOSTIC AGENTS
V04C OTHER DIAGNOSTIC AGENTS
V04CM Tests for fertility disturbances
V04CM01 Gonadorelin
D08027 Gonadorelin (INN)
Drug groups [BR:br08330]
Hormonal agent
DG01494 Gonadotropin-releasing hormone receptor agonist
DG00499 Gonadorelin
D08027 Gonadorelin
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Gonadotropin-releasing hormone
GNRHR
D08027 Gonadorelin (INN)
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 85
1 C8y C 12.8832 -12.9525
2 C8y C 12.4631 -14.2828
3 C8y C 14.2834 -12.9525
4 C8x C 12.1831 -11.6923
5 C1b C 11.2729 -14.9129
6 C8x C 13.5833 -15.0529
7 N4x N 14.7035 -14.2828
8 C8x C 14.9835 -11.7623
9 C8x C 12.8832 -10.5021
10 C1c C 11.2729 -16.3131
11 C8x C 14.2834 -10.5021
12 N1b N 10.0827 -17.0132
13 C5a C 12.4631 -17.0132
14 C5a C 8.8925 -16.3131
15 N1b N 13.6533 -16.3131
16 O5a O 12.4631 -18.4135
17 C1c C 7.7023 -17.0132
18 O5a O 8.8925 -14.9129
19 C1c C 14.8435 -17.0132
20 C1b C 7.7023 -18.4135
21 N1b N 6.4421 -16.3131
22 C5a C 16.0337 -16.3131
23 C1b C 14.8435 -18.4135
24 C8y C 8.8925 -19.1136
25 C5a C 5.2519 -17.0132
26 N1b N 17.2239 -17.0132
27 O5a O 16.0337 -14.9129
28 O1a O 16.0337 -19.0436
29 C8x C 10.1527 -18.6235
30 N4x N 8.8925 -20.5138
31 C1y C 4.0617 -16.3131
32 O5a O 5.2519 -18.4135
33 C1c C 18.4141 -16.3131
34 N5x N 11.0629 -19.7437
35 C8x C 10.2227 -20.8639
36 N1x N 4.0617 -14.9829
37 C1x C 2.8014 -16.7332
38 C1b C 18.4141 -14.9129
39 C5a C 19.6043 -17.0132
40 C5x C 2.8014 -14.5628
41 C1x C 1.9613 -15.6830
42 C8y C 19.6043 -14.2128
43 N1b N 20.7945 -16.3131
44 O5a O 19.6043 -18.3435
45 O5x O 2.3114 -13.2326
46 C8x C 20.7945 -14.9129
47 C8x C 19.6043 -12.8125
48 C1b C 22.0548 -16.9432
49 C8x C 22.0548 -14.2128
50 C8x C 20.7945 -12.1124
51 C5a C 23.2450 -16.3131
52 C8y C 22.0548 -12.8125
53 N1b N 24.4352 -16.9432
54 O5a O 23.2450 -14.9129
55 O1a O 23.2450 -12.1124
56 C1c C 25.6254 -16.3131
57 C5a C 26.8156 -16.9432
58 C1b C 25.6254 -14.9129
59 N1b N 28.0058 -16.2431
60 O5a O 26.8156 -18.3435
61 C1c C 26.8156 -14.2128
62 C1c C 29.1960 -16.9432
63 C1a C 26.8156 -12.8125
64 C1a C 28.0058 -14.9129
65 C5a C 30.3862 -16.2431
66 C1b C 29.1960 -18.3435
67 N1y N 31.5064 -16.9432
68 O5a O 30.3862 -14.9129
69 C1b C 28.0058 -19.0436
70 C1y C 32.9066 -16.9432
71 C1x C 31.1563 -18.2735
72 C1b C 28.0058 -20.4438
73 C1x C 33.3967 -18.2034
74 C5a C 34.0968 -16.2431
75 C1x C 32.2765 -19.0436
76 N1b N 26.8156 -21.0739
77 N1b N 35.2871 -16.9432
78 O5a O 34.0968 -14.8429
79 C2c C 25.6254 -20.4438
80 N1a N 25.6254 -19.0436
81 N2a N 24.3652 -21.0739
82 C1b C 36.4983 -16.2503
83 C5a C 37.6822 -16.9403
84 N1a N 38.8808 -16.2547
85 O5a O 37.6766 -18.3399
BOND 90
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1
8 4 9 2
9 10 5 1 #Up
10 8 11 2
11 10 12 1
12 10 13 1
13 12 14 1
14 13 15 1
15 13 16 2
16 14 17 1
17 14 18 2
18 15 19 1
19 17 20 1 #Down
20 17 21 1
21 19 22 1
22 19 23 1 #Down
23 20 24 1
24 21 25 1
25 22 26 1
26 22 27 2
27 23 28 1
28 24 29 2
29 24 30 1
30 31 25 1 #Down
31 25 32 2
32 26 33 1
33 29 34 1
34 30 35 1
35 31 36 1
36 31 37 1
37 33 38 1 #Up
38 33 39 1
39 36 40 1
40 37 41 1
41 38 42 1
42 39 43 1
43 39 44 2
44 40 45 2
45 42 46 2
46 42 47 1
47 43 48 1
48 46 49 1
49 47 50 2
50 48 51 1
51 49 52 2
52 51 53 1
53 51 54 2
54 52 55 1
55 53 56 1
56 56 57 1
57 56 58 1 #Up
58 57 59 1
59 57 60 2
60 58 61 1
61 59 62 1
62 61 63 1
63 61 64 1
64 62 65 1
65 62 66 1 #Down
66 65 67 1
67 65 68 2
68 66 69 1
69 67 70 1
70 67 71 1
71 69 72 1
72 70 73 1
73 70 74 1 #Down
74 71 75 1
75 72 76 1
76 74 77 1
77 74 78 2
78 76 79 1
79 79 80 1
80 79 81 2
81 6 7 1
82 9 11 1
83 34 35 2
84 40 41 1
85 50 52 1
86 73 75 1
87 77 82 1
88 82 83 1
89 83 84 1
90 83 85 2
|
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