| Entry |
|
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| Name |
Sorbitan sesquioleate (JP18/NF/INN);
Arlacel 83 (TN) |
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| Formula |
(C18H34O2)3. (C6H14O6)2
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| Exact mass |
1210.9257
|
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| Mol weight |
1211.7276
|
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| Structure |
|
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| Remark |
| Product (mixture): | D05239<JP> D05354<JP> |
|
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| Efficacy |
Pharmaceutic aid (surfactant) |
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| Comment |
Component of Absorptive ointment [DR: D05354]
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| Brite |
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D05282 Sorbitan sesquioleate
|
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| Other DBs |
|
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| KCF data |
ATOM 84
1 C1b C 29.8900 -21.2800
2 C1b C 31.0800 -22.0500
3 C1b C 28.7000 -22.0500
4 C2b C 32.3400 -21.2800
5 C1b C 27.4400 -21.2800
6 C2b C 33.7400 -21.2800
7 C1b C 26.2500 -22.0500
8 C1b C 34.9300 -22.0500
9 C1b C 25.0600 -21.2800
10 C1b C 36.1200 -21.2800
11 C1b C 23.8700 -22.0500
12 C1b C 37.3800 -22.0500
13 C6a C 22.6100 -21.2800
14 C1b C 38.5700 -21.2800
15 O6a O 21.4200 -22.0500
16 O6a O 22.6100 -19.8800
17 C1b C 39.7600 -22.0500
18 C1b C 40.9500 -21.2800
19 C1b C 42.2100 -22.0500
20 C1a C 43.4000 -21.2800
21 C1b C 22.6100 -16.1000
22 C1c C 23.8000 -16.8000
23 O1a O 21.4200 -16.8000
24 C1c C 24.9900 -16.1000
25 C1c C 26.1800 -16.8000
26 C1c C 27.3700 -16.1000
27 C1b C 28.5600 -16.8000
28 O1a O 29.7500 -16.1000
29 O1a O 27.3700 -14.7000
30 O1a O 24.9900 -14.7000
31 O1a O 26.1800 -18.2000
32 O1a O 23.8000 -18.2000
33 C1b C 29.8900 -21.2800
34 C1b C 31.0800 -22.0500
35 C2b C 32.3400 -21.2800
36 C2b C 33.7400 -21.2800
37 C1b C 34.9300 -22.0500
38 C1b C 36.1200 -21.2800
39 C1b C 37.3800 -22.0500
40 C1b C 38.5700 -21.2800
41 C1b C 39.7600 -22.0500
42 C1b C 40.9500 -21.2800
43 C1b C 42.2100 -22.0500
44 C1a C 43.4000 -21.2800
45 C1b C 28.7000 -22.0500
46 C1b C 27.4400 -21.2800
47 C1b C 26.2500 -22.0500
48 C1b C 25.0600 -21.2800
49 C1b C 23.8700 -22.0500
50 C6a C 22.6100 -21.2800
51 O6a O 21.4200 -22.0500
52 O6a O 22.6100 -19.8800
53 C1b C 29.8900 -21.2800
54 C1b C 31.0800 -22.0500
55 C2b C 32.3400 -21.2800
56 C2b C 33.7400 -21.2800
57 C1b C 34.9300 -22.0500
58 C1b C 36.1200 -21.2800
59 C1b C 37.3800 -22.0500
60 C1b C 38.5700 -21.2800
61 C1b C 39.7600 -22.0500
62 C1b C 40.9500 -21.2800
63 C1b C 42.2100 -22.0500
64 C1a C 43.4000 -21.2800
65 C1b C 28.7000 -22.0500
66 C1b C 27.4400 -21.2800
67 C1b C 26.2500 -22.0500
68 C1b C 25.0600 -21.2800
69 C1b C 23.8700 -22.0500
70 C6a C 22.6100 -21.2800
71 O6a O 21.4200 -22.0500
72 O6a O 22.6100 -19.8800
73 C1b C 22.6100 -16.1000
74 C1c C 23.8000 -16.8000
75 C1c C 24.9900 -16.1000
76 C1c C 26.1800 -16.8000
77 C1c C 27.3700 -16.1000
78 C1b C 28.5600 -16.8000
79 O1a O 29.7500 -16.1000
80 O1a O 27.3700 -14.7000
81 O1a O 26.1800 -18.2000
82 O1a O 24.9900 -14.7000
83 O1a O 23.8000 -18.2000
84 O1a O 21.4200 -16.8000
BOND 79
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 2
6 5 7 1
7 6 8 1
8 7 9 1
9 8 10 1
10 9 11 1
11 10 12 1
12 11 13 1
13 12 14 1
14 13 15 1
15 13 16 2
16 14 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 33 34 1
21 33 45 1
22 34 35 1
23 45 46 1
24 35 36 2
25 46 47 1
26 36 37 1
27 47 48 1
28 37 38 1
29 48 49 1
30 38 39 1
31 49 50 1
32 39 40 1
33 50 51 1
34 50 52 2
35 40 41 1
36 41 42 1
37 42 43 1
38 43 44 1
39 53 54 1
40 53 65 1
41 54 55 1
42 65 66 1
43 55 56 2
44 66 67 1
45 56 57 1
46 67 68 1
47 57 58 1
48 68 69 1
49 58 59 1
50 69 70 1
51 59 60 1
52 70 71 1
53 70 72 2
54 60 61 1
55 61 62 1
56 62 63 1
57 63 64 1
58 21 22 1
59 21 23 1
60 22 24 1
61 24 25 1
62 25 26 1
63 26 27 1
64 27 28 1
65 26 29 1 #Down
66 24 30 1 #Up
67 25 31 1 #Up
68 22 32 1 #Up
69 73 74 1
70 73 84 1
71 74 75 1
72 75 76 1
73 76 77 1
74 77 78 1
75 78 79 1
76 77 80 1 #Down
77 75 82 1 #Up
78 76 81 1 #Up
79 74 83 1 #Up
BRACKET 1 19.9500 -22.8200 19.9500 -19.1100
1 45.0800 -19.1100 45.0800 -22.8200
1 3
ORIGINAL 1 1 2 4 6 8 10 12 14 17 18 19 20 3 5 7 9
1 11 13 15 16
REPEAT 1 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48
1 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64
1 65 66 67 68 69 70 71 72
2 19.9500 -18.7600 19.9500 -14.0700
2 31.0800 -14.0700 31.0800 -18.7600
2 2
ORIGINAL 2 21 22 24 25 26 27 28 29 31 30 32 23
REPEAT 2 73 74 75 76 77 78 79 80 81 82 83 84
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