Entry |
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Name |
Gonadorelin acetate (USP); Luteinizing (TN) |
Formula |
C55H75N17O12. (C2H4O2)x. yH2O
|
Structure |
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Simcomp |
|
Class |
Hormonal agent
DG01494 Gonadotropin-releasing hormone receptor agonist
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Remark |
Product (DG00499): | D03267<JP> |
|
Efficacy |
Gonadotropin-releasing hormone receptor agonist |
Target |
|
Pathway |
hsa04080 | Neuroactive ligand-receptor interaction |
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Interaction |
|
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
D04361 Gonadorelin acetate (USP)
V VARIOUS
V04 DIAGNOSTIC AGENTS
V04C OTHER DIAGNOSTIC AGENTS
V04CM Tests for fertility disturbances
V04CM01 Gonadorelin
D04361 Gonadorelin acetate (USP)
Drug groups [BR:br08330]
Hormonal agent
DG01494 Gonadotropin-releasing hormone receptor agonist
DG00499 Gonadorelin
D04361 Gonadorelin acetate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Gonadotropin-releasing hormone
GNRHR
D04361 Gonadorelin acetate (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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LinkDB |
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KCF data |
ATOM 89
1 O6a O 6.5309 -23.2639
2 C6a C 7.7376 -22.5671
3 C1a C 8.9443 -23.2639
4 O6a O 7.7376 -21.1738
5 O0 O 15.1247 -23.4009
6 C8y C 16.4462 -14.0675
7 C8y C 16.0262 -15.3972
8 C8y C 17.8459 -14.0675
9 C8x C 15.7463 -12.8078
10 C1b C 14.8365 -16.0271
11 C8x C 17.1460 -16.1671
12 N4x N 18.2658 -15.3972
13 C8x C 18.5457 -12.8777
14 C8x C 16.4462 -11.6180
15 C1c C 14.8365 -17.4268
16 C8x C 17.8459 -11.6180
17 N1b N 13.6467 -18.1267
18 C5a C 16.0262 -18.1267
19 C5a C 12.4570 -17.4268
20 N1b N 17.2160 -17.4268
21 O5a O 16.0262 -19.5264
22 C1c C 11.2672 -18.1267
23 O5a O 12.4570 -16.0271
24 C1c C 18.4058 -18.1267
25 C1b C 11.2672 -19.5264
26 N1b N 10.0075 -17.4268
27 C5a C 19.5955 -17.4268
28 C1b C 18.4058 -19.5264
29 C8y C 12.4570 -20.2263
30 C5a C 8.8177 -18.1267
31 N1b N 20.7853 -18.1267
32 O5a O 19.5955 -16.0271
33 O1a O 19.5955 -20.1563
34 C8x C 13.7167 -19.7364
35 N4x N 12.4570 -21.6260
36 C1y C 7.6279 -17.4268
37 O5a O 8.8177 -19.5264
38 C1c C 21.9751 -17.4268
39 N5x N 14.6265 -20.8562
40 C8x C 13.7867 -21.9759
41 N1x N 7.6279 -16.0971
42 C1x C 6.3682 -17.8468
43 C1b C 21.9751 -16.0271
44 C5a C 23.1648 -18.1267
45 C5x C 6.3682 -15.6772
46 C1x C 5.5283 -16.7970
47 C8y C 23.1648 -15.3273
48 N1b N 24.3546 -17.4268
49 O5a O 23.1648 -19.4564
50 O5x O 5.8783 -14.3475
51 C8x C 24.3546 -16.0271
52 C8x C 23.1648 -13.9275
53 C1b C 25.6143 -18.1267
54 C8x C 25.6143 -15.3273
55 C8x C 24.3546 -13.2277
56 C5a C 26.8042 -17.4268
57 C8x C 25.6143 -13.9275
58 N1b N 27.9940 -18.0567
59 O5a O 26.8042 -16.0271
60 C1c C 29.1837 -17.4268
61 C5a C 30.3735 -18.0567
62 C1b C 29.1837 -16.0271
63 N1b N 31.5632 -17.3569
64 O5a O 30.3735 -19.4564
65 C1c C 30.3735 -15.3273
66 C1c C 32.7530 -18.0567
67 C1a C 30.3735 -13.9275
68 C1a C 31.5632 -16.0271
69 C5a C 33.9428 -17.3569
70 C1b C 32.7530 -19.4564
71 N1y N 35.0625 -18.0567
72 O5a O 33.9428 -16.0271
73 C1b C 31.5632 -20.1563
74 C1y C 36.4623 -18.0567
75 C1x C 34.7126 -19.3864
76 C1b C 31.5632 -21.5560
77 C1x C 36.9522 -19.3165
78 C5a C 37.6520 -17.3569
79 C1x C 35.8324 -20.1563
80 N1b N 30.3735 -22.1859
81 N1b N 38.8418 -18.0567
82 O5a O 37.6520 -15.9571
83 C2c C 29.1837 -21.5560
84 N1a N 29.1837 -20.1563
85 N2a N 27.9240 -22.1859
86 C1b C 40.0618 -17.3589
87 C5a C 41.2555 -18.0547
88 N1a N 42.4492 -17.3719
89 O5a O 41.2499 -19.4599
BOND 92
1 1 2 1
2 2 3 1
3 2 4 2
4 6 7 1
5 6 8 2
6 6 9 1
7 7 10 1
8 7 11 2
9 8 12 1
10 8 13 1
11 9 14 2
12 15 10 1 #Up
13 13 16 2
14 15 17 1
15 15 18 1
16 17 19 1
17 18 20 1
18 18 21 2
19 19 22 1
20 19 23 2
21 20 24 1
22 22 25 1 #Down
23 22 26 1
24 24 27 1
25 24 28 1 #Down
26 25 29 1
27 26 30 1
28 27 31 1
29 27 32 2
30 28 33 1
31 29 34 2
32 29 35 1
33 36 30 1 #Down
34 30 37 2
35 31 38 1
36 34 39 1
37 35 40 1
38 36 41 1
39 36 42 1
40 38 43 1 #Up
41 38 44 1
42 41 45 1
43 42 46 1
44 43 47 1
45 44 48 1
46 44 49 2
47 45 50 2
48 47 51 2
49 47 52 1
50 48 53 1
51 51 54 1
52 52 55 2
53 53 56 1
54 54 57 2
55 56 58 1
56 56 59 2
57 58 60 1
58 60 61 1
59 60 62 1 #Up
60 61 63 1
61 61 64 2
62 62 65 1
63 63 66 1
64 65 67 1
65 65 68 1
66 66 69 1
67 66 70 1 #Down
68 69 71 1
69 69 72 2
70 70 73 1
71 71 74 1
72 71 75 1
73 73 76 1
74 74 77 1
75 74 78 1 #Down
76 75 79 1
77 76 80 1
78 78 81 1
79 78 82 2
80 80 83 1
81 83 84 1
82 83 85 2
83 11 12 1
84 14 16 1
85 39 40 2
86 45 46 1
87 55 57 1
88 77 79 1
89 81 86 1
90 86 87 1
91 87 88 1
92 87 89 2
BRACKET 1 5.0400 -24.1500 5.0400 -20.4400
1 10.6400 -20.4400 10.6400 -24.1500
1 x
ORIGINAL 1 1 2 3 4
REPEAT 1
2 13.0900 -24.1500 13.0900 -22.5400
2 15.7500 -22.5400 15.7500 -24.1500
2 y
ORIGINAL 2 5
REPEAT 2
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