| Entry |
|
|---|
| Name |
Cobamamide (JAN/INN);
Calomide (TN) |
|---|
| Formula |
C72H100CoN18O17P
|
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| Exact mass |
1578.6583
|
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| Mol weight |
1579.5818
|
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| Structure |
|
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| Simcomp |
|
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| Remark |
| Therapeutic category: | 3136 |
|
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| Efficacy |
Anti-anemic, Supplement (vitamin B12) |
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| Comment |
Coenzyme form of vitamin B12
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
B BLOOD AND BLOOD FORMING ORGANS
B03 ANTIANEMIC PREPARATIONS
B03B VITAMIN B12 AND FOLIC ACID
B03BA Vitamin B12 (cyanocobalamin and analogues)
B03BA04 Cobamamide
D00042 Cobamamide (JAN/INN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
3 Agents affecting metabolism
31 Vitamins
313 Vitamin B preparations
3136 Vitamin B12 preparations
D00042 Cobamamide (JAN/INN)
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 109
1 Z Co 15.2166 -11.6347 #+
2 N2x N 13.8876 -10.3735
3 N1y N 13.8876 -13.0312 #-
4 N2x N 16.5904 -10.4185
5 N2x N 16.5604 -13.0011
6 N5x N 17.3304 -21.7582
7 C1z C 12.6641 -10.5685
8 C2y C 14.1054 -9.1573
9 C1y C 12.6641 -12.8509
10 C2y C 14.0903 -14.2548
11 C2y C 16.3276 -9.1947
12 C2y C 17.8366 -10.5311
13 C2y C 16.3427 -14.2097
14 C2y C 17.8066 -12.8359
15 C8y C 18.4941 -22.1261
16 C8x C 16.6171 -22.7493
17 C1z C 12.1008 -9.4499
18 C1a C 11.4477 -10.8990
19 C1y C 12.9943 -8.5790
20 C2y C 15.2240 -8.7369
21 C1y C 12.1008 -13.9545
22 C1z C 12.9943 -14.8330
23 C2y C 15.2240 -14.6902
24 C1z C 17.4088 -8.5790
25 C1y C 18.3322 -9.3974
26 C2x C 18.2947 -11.6798
27 C1y C 17.4238 -14.8030
28 C1z C 18.3322 -13.9545
29 C8y C 18.4865 -23.3499
30 C8x C 19.5452 -21.5255
31 N4y N 17.3304 -23.7327
32 C1b C 9.2522 -9.4425
33 C1a C 11.7705 -8.2413
34 C1b C 13.0168 -7.3404
35 C1a C 15.2166 -7.4830
36 C1b C 10.7645 -14.0821
37 C1b C 12.6293 -17.0442
38 C1a C 13.8931 -17.5907
39 C1a C 15.2166 -15.9290
40 C1b C 17.4012 -7.3254
41 C1a C 15.9974 -6.2264
42 C1b C 19.5784 -9.3900
43 C1b C 17.5514 -16.0416
44 C1a C 19.5333 -13.6393
45 C1a C 18.7900 -15.1256
46 C8x C 19.5452 -23.9580
47 C8y C 20.6038 -22.1261
48 C1y C 11.7386 -25.9158
49 C5a C 8.6441 -8.3689
50 C1b C 11.9508 -6.7173
51 C5a C 10.3290 -15.2308
52 C1b C 11.4081 -17.3873
53 C5a C 18.4748 -6.7023
54 C1b C 20.1791 -8.3088
55 C1b C 18.6775 -16.5521
56 C8y C 20.6038 -23.3499
57 C1a C 21.6623 -21.5255
58 C1y C 11.3707 -24.7447
59 O2x O 10.6799 -26.5165
60 N1a N 7.4053 -8.4239
61 O5a O 9.2672 -7.3027
62 C5a C 11.9658 -5.4711
63 N1a N 9.1054 -15.4335
64 O5a O 11.1100 -16.1768
65 C5a C 11.4007 -18.6336
66 N1a N 18.4674 -5.4561
67 O5a O 19.5560 -7.3178
68 C5a C 21.4253 -8.3014
69 C5a C 18.7977 -17.7833
70 C1a C 21.6623 -23.9580
71 C1y C 10.1395 -24.7297
72 O1a O 12.0989 -23.7687
73 C1y C 9.7641 -25.8858
74 N1a N 10.8923 -4.8477
75 O5a O 13.0468 -4.8628
76 N1b N 10.3271 -19.2567
77 O5a O 12.4593 -19.2643
78 N1a N 22.0410 -7.2202
79 O5a O 22.0558 -9.3824
80 N1a N 17.7842 -18.4966
81 O5a O 19.9387 -18.3015
82 O2b O 9.4336 -23.7312
83 C1b C 8.5103 -26.3062
84 C1b C 10.3271 -20.5406
85 P1b P 8.0748 -23.1306
86 O1a O 8.2551 -27.5975
87 C1c C 9.2085 -21.1861
88 O2b O 9.2159 -22.4700
89 O1c O 6.9338 -22.4700 #-
90 O1c O 7.1439 -24.0615
91 C1a C 8.1049 -20.5406
92 C1y C 22.8073 -12.6701
93 O2x O 23.8282 -11.9268
94 C1y C 23.2050 -13.8713
95 C1y C 24.8793 -12.7152
96 C1y C 24.4813 -13.8713
97 O1a O 22.7922 -15.0874
98 N4y N 26.0654 -12.3322
99 O1a O 25.0896 -14.9224
100 C8y C 27.0491 -13.0154
101 C8x C 26.5085 -11.0409
102 C8y C 28.1902 -12.1746
103 N5x N 27.1691 -14.3293
104 N5x N 27.8449 -11.0485
105 C8y C 29.3539 -12.6925
106 C8x C 28.4003 -14.8697
107 N5x N 29.5039 -14.0589
108 N1a N 30.3748 -11.9268
109 C1b C 21.4859 -11.6156 #-
BOND 119
1 1 3 1
2 2 7 1
3 2 8 2
4 3 9 1
5 3 10 1
6 4 11 1
7 4 12 2
8 5 13 2
9 5 14 1
10 6 15 1
11 6 16 2
12 7 17 1
13 7 18 1 #Down
14 8 19 1
15 8 20 1
16 9 21 1
17 10 22 1
18 10 23 2
19 11 24 1
20 12 25 1
21 12 26 1
22 13 27 1
23 14 28 1
24 15 29 2
25 15 30 1
26 16 31 1
27 17 32 1 #Up
28 17 33 1 #Down
29 19 34 1 #Down
30 20 35 1
31 21 36 1 #Up
32 22 37 1 #Down
33 22 38 1 #Up
34 23 39 1
35 24 40 1 #Up
36 24 41 1 #Down
37 25 42 1 #Down
38 27 43 1 #Down
39 28 44 1
40 28 45 1
41 29 46 1
42 30 47 2
43 48 31 1 #Up
44 32 49 1
45 34 50 1
46 36 51 1
47 37 52 1
48 40 53 1
49 42 54 1
50 43 55 1
51 46 56 2
52 47 57 1
53 48 58 1
54 48 59 1
55 49 60 1
56 49 61 2
57 50 62 1
58 51 63 1
59 51 64 2
60 52 65 1
61 53 66 1
62 53 67 2
63 54 68 1
64 55 69 1
65 56 70 1
66 58 71 1
67 58 72 1 #Up
68 73 59 1
69 62 74 1
70 62 75 2
71 65 76 1
72 65 77 2
73 68 78 1
74 68 79 2
75 69 80 1
76 69 81 2
77 71 82 1 #Up
78 73 83 1 #Down
79 76 84 1
80 82 85 1
81 83 86 1
82 84 87 1
83 85 88 1
84 85 89 1
85 85 90 2
86 87 91 1 #Down
87 7 9 1
88 11 20 2
89 13 23 1
90 14 26 2
91 17 19 1
92 21 22 1
93 24 25 1
94 27 28 1
95 29 31 1
96 47 56 1
97 71 73 1
98 87 88 1
99 92 93 1
100 92 94 1
101 93 95 1
102 94 96 1
103 94 97 1 #Down
104 95 98 1 #Up
105 96 99 1 #Down
106 98 100 1
107 98 101 1
108 100 102 2
109 100 103 1
110 101 104 2
111 102 105 1
112 103 106 2
113 105 107 2
114 105 108 1
115 95 96 1
116 102 104 1
117 106 107 1
118 92 109 1 #Up
119 1 109 1
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