| Entry |
|
|---|
| Name |
Belotecan hydrochloride (USAN) |
|---|
| Formula |
C25H27N3O4. HCl
|
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| Exact mass |
469.1768
|
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| Mol weight |
469.96
|
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| Structure |
|
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| Simcomp |
|
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| Class |
Antineoplastic
DG01529 Topoisomerase inhibitor
DG01526 Topoisomerase I inhibitor
|
|---|
| Remark |
|
|---|
| Efficacy |
Antineoplastic, Topoisomerase I inhibitor |
|---|
| Comment |
Camptothecine derivative
|
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| Target |
|
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| Interaction |
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
L01 ANTINEOPLASTIC AGENTS
L01C PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
L01CE Topoisomerase 1 (TOP1) inhibitors
L01CE04 Belotecan
D03225 Belotecan hydrochloride (USAN)
Drug groups [BR:br08330]
Antineoplastic
DG01529 Topoisomerase inhibitor
DG01526 Topoisomerase I inhibitor
D03225 Belotecan hydrochloride
Target-based classification of drugs [BR:br08310]
Enzymes
Isomerases (EC5)
DNA topoisomerase
TOP1
D03225 Belotecan hydrochloride (USAN)
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 33
1 C8x C 19.6901 -18.4227
2 C8x C 19.6901 -19.8238
3 C8x C 20.9035 -20.5243
4 C8y C 22.1169 -19.8238
5 C8y C 22.1169 -18.4227
6 C8x C 20.9035 -17.7221
7 N5x N 23.3302 -20.5243
8 C8y C 24.5435 -19.8238
9 C8y C 24.5435 -18.4227
10 C8y C 23.3302 -17.7221
11 C8y C 25.8760 -20.2567
12 N4y N 26.6996 -19.1232
13 C1x C 25.8760 -17.9898
14 C1b C 23.3302 -16.3211
15 C8y C 28.0996 -19.1232
16 C8y C 28.7861 -20.3130
17 C1x C 30.1699 -20.3132
18 C8y C 28.0875 -21.5224
19 C8x C 26.6704 -21.5224
20 O5x O 28.7978 -17.9140
21 O7x O 30.8641 -21.5158
22 C7x C 30.1764 -22.7061
23 C1z C 28.7702 -22.7059
24 O6a O 30.8634 -23.8963
25 C1b C 27.3702 -22.7053
26 C1a C 26.6805 -23.8985
27 O1a O 28.7702 -24.1059
28 C1b C 24.5321 -15.6270
29 N1b N 25.7132 -16.3087
30 C1c C 26.9075 -15.6188
31 C1a C 28.0956 -16.3046
32 C1a C 26.9074 -14.2103
33 X Cl 33.9500 -21.5600
BOND 36
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 2
7 4 7 2
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 2
12 8 11 1
13 11 12 1
14 12 13 1
15 9 13 1
16 10 14 1
17 12 15 1
18 15 16 1
19 16 17 1
20 16 18 2
21 18 19 1
22 19 11 2
23 15 20 2
24 17 21 1
25 21 22 1
26 22 23 1
27 23 18 1
28 22 24 2
29 23 25 1 #Down
30 25 26 1
31 23 27 1 #Up
32 14 28 1
33 28 29 1
34 29 30 1
35 30 31 1
36 30 32 1
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