Entry |
|
Name |
Norcholestenol iodomethyl (131I) (JAN); Adosterol (TN) |
Formula |
C27H45IO
|
Exact mass |
516.2532
|
Mol weight |
512.5501
|
Structure |
|
Simcomp |
|
Remark |
Therapeutic category: | 4300 |
|
Efficacy |
Diagnostic aid, Radioactive agent |
Interaction |
|
Brite |
Therapeutic category of drugs in Japan [BR:br08301]
4 Agents affecting cellular function
43 Radioactive drugs
430 Radioactive drugs
4300 Radioactive drugs
D02043 Norcholestenol iodomethyl (131I) (JAN)
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Other DBs |
|
LinkDB |
|
KCF data |
ATOM 29
1 C1x C 10.5000 -7.7700
2 C1y C 10.5000 -9.1700
3 C1x C 11.7124 -9.8700
4 C2y C 12.9249 -9.1700
5 C2y C 12.9249 -7.7700
6 C1x C 11.7124 -7.0700
7 C1y C 14.1373 -9.8700
8 C1x C 15.3497 -9.1700
9 C1y C 15.3497 -7.7700
10 C1y C 14.1373 -7.0700
11 C1y C 16.5622 -7.0700
12 C1z C 16.5622 -5.6700
13 C1x C 15.3497 -4.9700
14 C1x C 14.1373 -5.6700
15 C1x C 18.9870 -7.0700
16 C1x C 18.9870 -5.6700
17 C1y C 17.7746 -4.9700
18 O1a O 9.2876 -9.8700
19 C1b C 14.1373 -11.2700
20 C1a C 16.5622 -4.2700
21 C1c C 17.7746 -3.5700
22 C1b C 18.9911 -2.8677
23 C1a C 16.5662 -2.8723
24 X I 12.9269 -11.9688
25 C1b C 20.1886 -3.5592
26 C1b C 21.3749 -2.8743
27 C1c C 22.5667 -3.5626
28 C1a C 23.7559 -2.8761
29 C1a C 22.5667 -4.9697
BOND 32
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 2 18 1 #Up
22 7 19 1 #Up
23 12 20 1 #Up
24 17 21 1 #Up
25 21 22 1
26 21 23 1 #Down
27 19 24 1
28 22 25 1
29 25 26 1
30 26 27 1
31 27 28 1
32 27 29 1
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