| Entry |
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| Name |
Technetium Tc99m trofolastat chloride (USAN/INN) |
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| Formula |
C37H50N10O20. Tc. (CO)3. Cl
|
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| Exact mass |
1172.1801
|
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| Mol weight |
1172.33
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| Structure |
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| Remark |
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| Efficacy |
Diagnostic |
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| Target |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
V VARIOUS
V09 DIAGNOSTIC RADIOPHARMACEUTICALS
V09I TUMOUR DETECTION
V09IA Technetium (99mTc) compounds
V09IA10 Technetium (99mTc) trofolastat chloride
D10683 Technetium Tc99m trofolastat chloride (USAN/INN)
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases (EC3)
Metallocarboxypeptidases
FOLH1 (PSMA)
D10683 Technetium Tc99m trofolastat chloride (USAN/INN)
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 75
1 X Cl 26.3244 -14.1077 #-
2 C3a C 11.6900 -11.9700 #-
3 O0 O 11.6900 -10.5700 #+
4 O0 O 8.1200 -12.6000 #+
5 C3a C 9.4724 -13.2300 #-
6 N1c N 15.1500 -15.5743
7 C1b C 16.2674 -14.8061
8 C1b C 15.1500 -16.9711
9 C8y C 13.9627 -17.5997
10 C8y C 15.9182 -13.4791
11 N4y N 16.7563 -12.4315
12 C8x C 16.0579 -11.2442
13 C8x C 14.7310 -11.5934
14 N5x N 14.6611 -12.9902
15 N5x N 12.7056 -17.1108
16 C8x C 11.7977 -18.1584
17 C8x C 12.4961 -19.2758
18 N4y N 13.8230 -18.9965
19 C1b C 15.0103 -19.6949
20 C5a C 15.0103 -21.0917
21 N1c N 13.8230 -21.7901
22 C1b C 13.8230 -23.1170
23 C6a C 15.0103 -23.8154
24 O6a O 16.1976 -23.1170
25 O5a O 16.1976 -21.7202
26 C1b C 12.4961 -21.0218
27 C6a C 11.1691 -21.7901
28 O6a O 11.1691 -23.1170
29 O6a O 9.9818 -21.0917
30 O6a O 15.0103 -25.2122
31 C1b C 17.9436 -11.7331
32 C5a C 19.2007 -12.4315
33 N1c N 20.3880 -11.7331
34 C1b C 21.5753 -12.4315
35 C6a C 22.7626 -11.7331
36 O6a O 23.9498 -12.4315
37 O6a O 22.7626 -10.3363
38 C1b C 20.3880 -10.3363
39 C6a C 19.2007 -9.6379
40 O6a O 17.9436 -10.3363
41 O6a O 19.2007 -8.2411
42 C1b C 16.3373 -16.2727
43 C1b C 17.5246 -15.5743
44 C1b C 18.7817 -16.2727
45 C1b C 19.9690 -15.5743
46 C1c C 21.1562 -16.2727
47 C6a C 22.3435 -15.5743
48 O6a O 23.5308 -16.2727
49 O6a O 22.3435 -14.1775
50 N1b N 21.1562 -17.6695
51 C5a C 20.4578 -18.8568
52 C1b C 21.1562 -20.0441
53 C1b C 20.4578 -21.2314
54 C1c C 21.1562 -22.4186
55 C6a C 18.9214 -23.3964
56 O6a O 18.9214 -24.7932
57 O6a O 17.7341 -22.6980
58 N1b N 22.3435 -23.1170
59 C5a C 23.5308 -22.4186
60 N1b N 24.7181 -23.1170
61 C1c C 25.9054 -22.4186
62 C6a C 27.1625 -23.1170
63 O6a O 28.3498 -22.4186
64 O6a O 27.1625 -24.5138
65 C1b C 25.9054 -21.0218
66 O5a O 23.5308 -21.0218
67 C1b C 27.1625 -20.3234
68 C6a C 27.1625 -18.9965
69 O6a O 25.9054 -18.2981
70 O5a O 19.2007 -13.7585
71 O5a O 19.0610 -18.8568
72 O6a O 28.3498 -18.2981
73 C3a C 9.3800 -15.6100 #-
74 O0 O 8.1676 -16.3100 #+
75 Z Tc 11.9000 -14.4200 #+
BOND 71
1 2 3 3
2 4 5 3
3 6 7 1
4 6 8 1
5 8 9 1
6 7 10 1
7 10 11 1
8 11 12 1
9 12 13 2
10 13 14 1
11 10 14 2
12 9 15 2
13 15 16 1
14 16 17 2
15 17 18 1
16 9 18 1
17 18 19 1
18 19 20 1
19 20 21 1
20 21 22 1
21 22 23 1
22 23 24 2
23 20 25 2
24 21 26 1
25 26 27 1
26 27 28 2
27 27 29 1
28 23 30 1
29 11 31 1
30 31 32 1
31 32 33 1
32 33 34 1
33 34 35 1
34 35 36 1
35 35 37 2
36 33 38 1
37 38 39 1
38 39 40 1
39 39 41 2
40 6 42 1
41 42 43 1
42 43 44 1
43 44 45 1
44 45 46 1
45 46 47 1
46 47 48 1
47 47 49 2
48 46 50 1 #Up
49 50 51 1
50 51 52 1
51 52 53 1
52 53 54 1
53 54 55 1 #Down
54 55 56 1
55 55 57 2
56 54 58 1
57 58 59 1
58 59 60 1
59 60 61 1
60 61 62 1
61 62 63 1
62 62 64 2
63 61 65 1 #Up
64 59 66 2
65 65 67 1
66 67 68 1
67 68 69 1
68 32 70 2
69 51 71 2
70 68 72 2
71 73 74 3
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