Entry |
|
Name |
Cellacefate (JP18/INN/NF); Cellulose acetate phthalate |
Formula |
(C32H32O18)n
|
Structure |
|
Simcomp |
|
Efficacy |
Pharmaceutic aid (tablet coating) |
Brite |
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D01541 Cellulose acetate phthalate
|
Other DBs |
|
KCF data |
ATOM 52
1 Z * 37.6341 -11.2475
2 C1x C 31.3679 -11.2839
3 O2x O 30.2130 -10.6130
4 C1y C 31.3679 -12.6197
5 C1y C 29.0521 -11.2839
6 C1y C 30.2130 -13.2907
7 O7a O 32.5347 -13.2907
8 C1y C 29.0521 -12.6197
9 C1b C 27.9087 -10.6130
10 O1a O 30.2130 -14.6264
11 O2a O 27.9030 -13.2847
12 C1y C 26.7421 -13.9557
13 O2x O 25.5754 -13.2847
14 C1y C 26.7421 -15.2914
15 C1y C 24.4203 -13.9557
16 C1y C 25.5754 -15.9623
17 O1a O 27.9030 -15.9623
18 C1y C 24.4203 -15.2914
19 C1b C 23.2711 -13.2847
20 O7a O 25.5754 -17.2983
21 O1a O 23.2711 -15.9623
22 C7a C 32.5370 -15.0288
23 C8y C 33.7469 -15.7244
24 O6a O 31.3295 -15.7286
25 C8y C 33.7417 -17.1174
26 C8x C 34.9516 -17.8132
27 C8x C 36.1589 -17.1134
28 C8x C 36.1566 -15.7178
29 C8x C 34.9467 -15.0220
30 C7a C 25.5633 -18.6925
31 O6a O 24.3488 -19.3800
32 C8y C 26.7661 -19.4007
33 C8y C 26.7494 -20.7927
34 C8x C 27.9520 -21.5008
35 C8x C 29.1666 -20.8133
36 C8x C 29.1785 -19.4176
37 C8x C 27.9759 -18.7096
38 C6a C 25.5353 -21.4767
39 O6a O 24.3340 -20.7664
40 O6a O 25.5206 -22.8724
41 C6a C 32.5323 -17.8141
42 O6a O 31.3243 -17.1151
43 O6a O 32.5310 -19.2097
44 Z * 16.6097 -15.9424
45 O7a O 22.0253 -13.9960
46 C7a C 20.8365 -13.3018
47 C1a C 19.6392 -13.9854
48 O6a O 20.8434 -11.9001
49 O7a O 26.6964 -11.3019
50 C7a C 25.4551 -10.5743
51 C1a C 24.2588 -11.2547
52 O6a O 25.4642 -9.1701
BOND 55
1 3 5 1
2 4 6 1
3 4 7 1 #Down
4 5 8 1
5 23 25 2
6 25 26 1
7 26 27 2
8 27 28 1
9 28 29 2
10 29 23 1
11 5 9 1 #Up
12 6 10 1 #Up
13 20 30 1
14 8 11 1 #Down
15 30 31 2
16 30 32 1
17 12 11 1 #Up
18 12 13 1
19 12 14 1
20 13 15 1
21 14 16 1
22 32 33 2
23 33 34 1
24 34 35 2
25 35 36 1
26 36 37 2
27 37 32 1
28 14 17 1 #Down
29 33 38 1
30 15 18 1
31 38 39 1
32 15 19 1 #Up
33 38 40 2
34 16 20 1 #Up
35 18 21 1 #Down
36 6 8 1
37 25 41 1
38 16 18 1
39 41 42 1
40 41 43 2
41 7 22 1
42 2 1 1
43 22 23 1
44 2 3 1
45 22 24 2
46 2 4 1
47 21 44 1
48 19 45 1
49 45 46 1
50 46 47 1
51 46 48 2
52 9 49 1
53 49 50 1
54 50 51 1
55 50 52 2
BRACKET 1 18.2000 -23.3100 18.2000 -8.6100
1 36.3300 -8.6100 36.3300 -23.3100
1 n
ORIGINAL 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17
1 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33
1 34 35 36 37 38 39 40 41 42 43 45 46 47 48 49 50
1 51 52
REPEAT 1
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