| Entry |
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| Name |
Gonadorelin diacetate (JP18) |
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| Formula |
C55H75N17O13. (C2H4O2)2
|
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| Exact mass |
1301.6153
|
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| Mol weight |
1302.394
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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 |
Diagnostic (pituitary function determination), Gonadotropin-releasing hormone receptor agonist |
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| Target |
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| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
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| Network |
| nt06323 | KISS1-GnRH-LH/FSH-E2 signaling |
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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
D03267 Gonadorelin diacetate (JP18) <JP>
V VARIOUS
V04 DIAGNOSTIC AGENTS
V04C OTHER DIAGNOSTIC AGENTS
V04CM Tests for fertility disturbances
V04CM01 Gonadorelin
D03267 Gonadorelin diacetate (JP18) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
2 Agents affecting individual organs
24 Hormones
249 Miscellaneous
2499 Others
D03267 Gonadorelin diacetate (JP18)
7 Agents not mainly for therapeutic purpose
72 Intracorporeal diagnostic agents
722 Various function testing reagents
7223 Diagnostic reagents for endocrine function
D03267 Gonadorelin diacetate (JP18)
Drug groups [BR:br08330]
Hormonal agent
DG01494 Gonadotropin-releasing hormone receptor agonist
DG00499 Gonadorelin
D03267 Gonadorelin diacetate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Gonadotropin-releasing hormone
GNRHR
D03267 Gonadorelin diacetate (JP18) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D03267 Gonadorelin acetate
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 93
1 O6a O 3.5909 -21.7939
2 C6a C 4.7976 -21.0971
3 C1a C 6.0043 -21.7939
4 O6a O 4.7976 -19.7038
5 C8y C 13.5062 -12.1075
6 C8y C 13.0862 -13.4372
7 C8y C 14.9059 -12.1075
8 C8x C 12.8063 -10.8478
9 C1b C 11.8965 -14.0671
10 C8x C 14.2060 -14.2071
11 N4x N 15.3258 -13.4372
12 C8x C 15.6057 -10.9177
13 C8x C 13.5062 -9.6580
14 C1c C 11.8965 -15.4668
15 C8x C 14.9059 -9.6580
16 N1b N 10.7067 -16.1667
17 C5a C 13.0862 -16.1667
18 C5a C 9.5170 -15.4668
19 N1b N 14.2760 -15.4668
20 O5a O 13.0862 -17.5664
21 C1c C 8.3272 -16.1667
22 O5a O 9.5170 -14.0671
23 C1c C 15.4658 -16.1667
24 C1b C 8.3272 -17.5664
25 N1b N 7.0675 -15.4668
26 C5a C 16.6555 -15.4668
27 C1b C 15.4658 -17.5664
28 C8y C 9.5170 -18.2663
29 C5a C 5.8777 -16.1667
30 N1b N 17.8453 -16.1667
31 O5a O 16.6555 -14.0671
32 O1a O 16.6555 -18.1963
33 C8x C 10.7767 -17.7764
34 N5x N 9.5170 -19.6660
35 C1y C 4.6879 -15.4668
36 O5a O 5.8777 -17.5664
37 C1c C 19.0351 -15.4668
38 N4x N 11.6865 -18.8962
39 C8x C 10.8467 -20.0159
40 N1x N 4.6879 -14.1371
41 C1x C 3.4282 -15.8868
42 C1b C 19.0351 -14.0671
43 C5a C 20.2248 -16.1667
44 C5x C 3.4282 -13.7172
45 C1x C 2.5883 -14.8370
46 C8y C 20.2248 -13.3673
47 N1b N 21.4146 -15.4668
48 O5a O 20.2248 -17.4964
49 O5x O 2.9383 -12.3875
50 C8x C 21.4146 -14.0671
51 C8x C 20.2248 -11.9675
52 C1b C 22.6743 -16.1667
53 C8x C 22.6743 -13.3673
54 C8x C 21.4146 -11.2677
55 C5a C 23.8642 -15.4668
56 C8y C 22.6743 -11.9675
57 N1b N 25.0540 -16.0967
58 O5a O 23.8642 -14.0671
59 O1a O 23.8642 -11.2677
60 C1c C 26.2437 -15.4668
61 C5a C 27.4335 -16.0967
62 C1b C 26.2437 -14.0671
63 N1b N 28.6232 -15.3969
64 O5a O 27.4335 -17.4964
65 C1c C 27.4335 -13.3673
66 C1c C 29.8130 -16.0967
67 C1a C 27.4335 -11.9675
68 C1a C 28.6232 -14.0671
69 C5a C 31.0028 -15.3969
70 C1b C 29.8130 -17.4964
71 N1y N 32.1225 -16.0967
72 O5a O 31.0028 -14.0671
73 C1b C 28.6232 -18.1963
74 C1y C 33.5223 -16.0967
75 C1x C 31.7726 -17.4264
76 C1b C 28.6232 -19.5960
77 C1x C 34.0122 -17.3565
78 C5a C 34.7120 -15.3969
79 C1x C 32.8924 -18.1963
80 N1b N 27.4335 -20.2259
81 N1b N 35.9018 -16.0967
82 O5a O 34.7120 -13.9971
83 C2c C 26.2437 -19.5960
84 N1a N 26.2437 -18.1963
85 N2a N 24.9840 -20.2259
86 C1b C 37.1218 -15.3989
87 C5a C 38.3155 -16.0947
88 N1a N 39.5092 -15.4119
89 O5a O 38.3099 -17.4999
90 O6a O 3.5909 -21.7939
91 C6a C 4.7976 -21.0971
92 C1a C 6.0043 -21.7939
93 O6a O 4.7976 -19.7038
BOND 96
1 5 6 1
2 5 7 2
3 5 8 1
4 6 9 1
5 6 10 2
6 7 11 1
7 7 12 1
8 8 13 2
9 14 9 1 #Up
10 12 15 2
11 14 16 1
12 14 17 1
13 16 18 1
14 17 19 1
15 17 20 2
16 18 21 1
17 18 22 2
18 19 23 1
19 21 24 1 #Down
20 21 25 1
21 23 26 1
22 23 27 1 #Down
23 24 28 1
24 25 29 1
25 26 30 1
26 26 31 2
27 27 32 1
28 28 33 2
29 28 34 1
30 35 29 1 #Down
31 29 36 2
32 30 37 1
33 33 38 1
34 34 39 2
35 35 40 1
36 35 41 1
37 37 42 1 #Up
38 37 43 1
39 40 44 1
40 41 45 1
41 42 46 1
42 43 47 1
43 43 48 2
44 44 49 2
45 46 50 2
46 46 51 1
47 47 52 1
48 50 53 1
49 51 54 2
50 52 55 1
51 53 56 2
52 55 57 1
53 55 58 2
54 56 59 1
55 57 60 1
56 60 61 1
57 60 62 1 #Up
58 61 63 1
59 61 64 2
60 62 65 1
61 63 66 1
62 65 67 1
63 65 68 1
64 66 69 1
65 66 70 1 #Down
66 69 71 1
67 69 72 2
68 70 73 1
69 71 74 1
70 71 75 1
71 73 76 1
72 74 77 1
73 74 78 1 #Down
74 75 79 1
75 76 80 1
76 78 81 1
77 78 82 2
78 80 83 1
79 83 84 1
80 83 85 2
81 10 11 1
82 13 15 1
83 38 39 1
84 44 45 1
85 54 56 1
86 77 79 1
87 81 86 1
88 86 87 1
89 87 88 1
90 87 89 2
91 1 2 1
92 2 3 1
93 2 4 2
94 90 91 1
95 91 92 1
96 91 93 2
BRACKET 1 2.1000 -22.7500 2.1000 -18.8300
1 7.7700 -18.8300 7.7700 -22.7500
1 2
ORIGINAL 1 1 2 3 4
REPEAT 1 90 91 92 93
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