Entry |
|
Name |
Iobenguane sulfate I 131 (USAN); Iobenguane sulfate I 131 (TN) |
Formula |
(C8H10IN3)2. H2SO4
|
Exact mass |
651.9529
|
Mol weight |
648.2576
|
Structure |
|
Simcomp |
|
Remark |
Product (DG01194): | D03308<JP> |
|
Efficacy |
Diagnostic aid, Radioactive agent |
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
V VARIOUS
V09 DIAGNOSTIC RADIOPHARMACEUTICALS
V09I TUMOUR DETECTION
V09IX Other diagnostic radiopharmaceuticals for tumour detection
V09IX02 Iobenguane (131I)
D04560 Iobenguane sulfate I 131 (USAN)
V10 THERAPEUTIC RADIOPHARMACEUTICALS
V10X OTHER THERAPEUTIC RADIOPHARMACEUTICALS
V10XA Iodine (131I) compounds
V10XA02 Iobenguane (131I)
D04560 Iobenguane sulfate I 131 (USAN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 29
1 C8x C 27.4390 -13.1067
2 C8x C 26.2530 -12.4090
3 C8y C 27.4390 -14.4322
4 C8x C 25.0670 -13.1067
5 C8x C 26.2530 -15.1298
6 C8y C 25.0670 -14.4322
7 X I 23.5322 -15.4787
8 C1b C 28.6250 -15.1996
9 N1b N 29.7412 -14.5020
10 C2c C 30.9272 -15.1996
11 N1a N 32.1132 -14.5020
12 N2a N 30.9272 -16.5251
13 S4a S 37.5548 -14.5020
14 O1d O 37.5548 -13.1067
15 O1d O 37.5548 -15.8973
16 O1d O 36.1595 -14.5020
17 O1d O 38.9501 -14.5020
18 C8x C 27.4390 -13.1067
19 C8x C 26.2530 -12.4090
20 C8x C 25.0670 -13.1067
21 C8y C 25.0670 -14.4322
22 C8x C 26.2530 -15.1298
23 C8y C 27.4390 -14.4322
24 C1b C 28.6250 -15.1996
25 N1b N 29.7412 -14.5020
26 C2c C 30.9272 -15.1996
27 N1a N 32.1132 -14.5020
28 N2a N 30.9272 -16.5251
29 X I 23.5322 -15.4787
BOND 28
1 13 14 2
2 13 15 2
3 13 16 1
4 13 17 1
5 4 6 2
6 5 6 1
7 6 7 1
8 3 8 1
9 1 2 2
10 8 9 1
11 1 3 1
12 9 10 1
13 2 4 1
14 10 11 1
15 3 5 2
16 10 12 2
17 20 21 2
18 22 21 1
19 21 29 1
20 23 24 1
21 18 19 2
22 24 25 1
23 18 23 1
24 25 26 1
25 19 20 1
26 26 27 1
27 23 22 2
28 26 28 2
BRACKET 1 22.1200 -17.2900 22.1200 -11.6200
1 33.4600 -11.6200 33.4600 -17.2900
1 2
ORIGINAL 1 1 2 4 6 5 3 8 9 10 11 12 7
REPEAT 1 18 19 20 21 22 23 24 25 26 27 28 29
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