| Entry |
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| Name |
Diphenidol pamoate (USAN) |
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| Formula |
(C21H27NO)2. C23H16O6
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| Exact mass |
1006.5132
|
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| Mol weight |
1007.2599
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| Structure |
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| Remark |
| Product (DG02880): | D01318<JP> |
|
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| Efficacy |
Anti-emetic |
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| Target |
|
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| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
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| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM
D03859 Diphenidol pamoate (USAN)
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| Other DBs |
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| KCF data |
ATOM 75
1 C1d C 6.5919 -10.0047
2 C8y C 5.3901 -10.6988
3 C8y C 7.8052 -10.6988
4 C1b C 6.5977 -8.6163
5 O1a O 5.2325 -9.1529
6 C8x C 5.3901 -12.0872
7 C8x C 4.1941 -10.0047
8 C8x C 7.8635 -12.0872
9 C8x C 9.0011 -10.0047
10 C1b C 7.8052 -7.9221
11 C8x C 4.1941 -12.7815
12 C8x C 2.9925 -10.6988
13 C8x C 8.9954 -12.7815
14 C8x C 10.2730 -10.6988
15 C1b C 7.8052 -6.5337
16 C8x C 2.9925 -12.0872
17 C8x C 10.2668 -12.0872
18 N1y N 9.0071 -5.8453
19 C1x C 10.2030 -6.5394
20 C1x C 9.0011 -4.4570
21 C1x C 11.4045 -5.8453
22 C1x C 10.2086 -3.7626
23 C1x C 11.4045 -4.4570
24 C8x C 13.6079 -9.5274
25 C8x C 13.6079 -10.9072
26 C8x C 14.8027 -11.5970
27 C8x C 15.9977 -10.9072
28 C8y C 15.9977 -9.5274
29 C8y C 14.8027 -8.8376
30 C8y C 17.1925 -8.8376
31 C8y C 17.1925 -7.4578
32 C8y C 15.9977 -6.7680
33 C8x C 14.8027 -7.4578
34 C1b C 19.0793 -9.6666
35 C8y C 20.6724 -8.8476
36 C8y C 21.8420 -9.5229
37 C8y C 23.0369 -8.8329
38 C8x C 23.0369 -7.4532
39 C8y C 21.8672 -6.7780
40 C8y C 20.6723 -7.4679
41 C8x C 21.8420 -10.9026
42 C8x C 23.0370 -11.5924
43 C8x C 24.2318 -10.9025
44 C8x C 24.2318 -9.5228
45 C6a C 15.9977 -5.3884
46 O6a O 17.2111 -4.6877
47 O6a O 14.8214 -4.7092
48 C6a C 21.8670 -5.3883
49 O6a O 20.6865 -4.7069
50 O6a O 23.0762 -4.6899
51 O1a O 18.3894 -6.7668
52 O1a O 19.4522 -6.7634
53 C1d C 6.5919 -10.0047
54 C8y C 5.3901 -10.6988
55 C8x C 5.3901 -12.0872
56 C8x C 4.1941 -12.7815
57 C8x C 2.9925 -12.0872
58 C8x C 2.9925 -10.6988
59 C8x C 4.1941 -10.0047
60 C8y C 7.8052 -10.6988
61 C8x C 7.8635 -12.0872
62 C8x C 8.9954 -12.7815
63 C8x C 10.2668 -12.0872
64 C8x C 10.2730 -10.6988
65 C8x C 9.0011 -10.0047
66 C1b C 6.5977 -8.6163
67 C1b C 7.8052 -7.9221
68 C1b C 7.8052 -6.5337
69 N1y N 9.0071 -5.8453
70 C1x C 10.2030 -6.5394
71 C1x C 11.4045 -5.8453
72 C1x C 11.4045 -4.4570
73 C1x C 10.2086 -3.7626
74 C1x C 9.0011 -4.4570
75 O1a O 5.2325 -9.1529
BOND 82
1 24 25 2
2 25 26 1
3 26 27 2
4 27 28 1
5 28 29 2
6 24 29 1
7 28 30 1
8 30 31 2
9 31 32 1
10 32 33 2
11 29 33 1
12 30 34 1
13 34 35 1
14 35 36 1
15 36 37 2
16 37 38 1
17 38 39 2
18 39 40 1
19 35 40 2
20 36 41 1
21 41 42 2
22 42 43 1
23 43 44 2
24 37 44 1
25 32 45 1
26 45 46 2
27 45 47 1
28 39 48 1
29 48 49 2
30 48 50 1
31 31 51 1
32 40 52 1
33 1 2 1
34 1 3 1
35 1 4 1
36 1 5 1
37 2 6 1
38 2 7 2
39 3 8 2
40 3 9 1
41 4 10 1
42 6 11 2
43 7 12 1
44 8 13 1
45 9 14 2
46 10 15 1
47 11 16 1
48 13 17 2
49 15 18 1
50 18 19 1
51 18 20 1
52 19 21 1
53 20 22 1
54 21 23 1
55 12 16 2
56 14 17 1
57 22 23 1
58 53 54 1
59 53 60 1
60 53 66 1
61 53 75 1
62 54 55 1
63 54 59 2
64 60 61 2
65 60 65 1
66 66 67 1
67 55 56 2
68 59 58 1
69 61 62 1
70 65 64 2
71 67 68 1
72 56 57 1
73 62 63 2
74 68 69 1
75 69 70 1
76 69 74 1
77 70 71 1
78 74 73 1
79 71 72 1
80 58 57 2
81 64 63 1
82 73 72 1
BRACKET 1 2.1000 -13.4400 2.1000 -2.3100
1 12.1100 -2.3100 12.1100 -13.4400
1 2
ORIGINAL 1 1 2 6 11 16 12 7 3 8 13 17 14 9 4 10 15
1 18 19 21 23 22 20 5
REPEAT 1 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68
1 69 70 71 72 73 74 75
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