| Entry |
|
|---|
| Name |
Fosifloxuridine nafalbenamide |
|---|
| Formula |
C29H29FN3O9P
|
|---|
| Exact mass |
613.1625
|
|---|
| Mol weight |
613.53
|
|---|
| Structure |
|
|---|
| Class |
Antineoplastic
DG02018 Antimetabolite
DG01958 Nucleic acid derivative, antineoplastic
DG01935 Fluoropyrimidine antineoplastic
|
|---|
| Efficacy |
Antineoplastic, Antimetabolite |
|---|
| Comment |
Active form of prodrug: Floxuridine [DR: D04197]
Treatment of colorectal cancer
|
|---|
| Target |
|
|---|
| Pathway |
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|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antineoplastic
DG02018 Antimetabolite
DG01958 Nucleic acid derivative, antineoplastic
DG01935 Fluoropyrimidine antineoplastic
D12388 Fosifloxuridine nafalbenamide
Target-based classification of drugs [BR:br08310]
Enzymes
Transferases (EC2)
Methyltransferases
TYMS
D12388 Fosifloxuridine nafalbenamide
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 43
1 C1y C 18.3400 -16.8000
2 O2x O 17.2200 -16.0300
3 C1x C 17.9200 -18.1300
4 C1y C 16.1000 -16.8000
5 C1y C 16.5200 -18.1300
6 O1a O 15.7500 -19.1800
7 N4y N 19.7400 -16.3100
8 C8x C 19.7400 -14.8400
9 C8y C 20.9300 -17.0100
10 N4x N 22.1900 -16.3100
11 C8y C 22.1900 -14.8400
12 C8y C 20.9300 -14.1400
13 X F 20.9300 -12.7400
14 O5x O 23.3800 -14.1400
15 O5x O 20.9300 -18.4100
16 C1b C 14.9100 -16.1000
17 O2b O 13.7200 -16.8000
18 P1b P 12.5019 -16.1099
19 N1b N 11.3205 -16.8050
20 C1c C 10.1151 -16.1220
21 C7a C 8.9439 -16.8109
22 O7a O 7.7335 -16.1249
23 O6a O 8.9552 -18.2000
24 C1b C 6.5134 -16.8429
25 C8y C 5.3043 -16.1584
26 C8x C 5.2927 -14.7703
27 C8x C 4.0745 -14.0804
28 C8x C 2.8679 -14.7905
29 C8x C 2.8795 -16.1787
30 C8x C 4.0978 -16.8685
31 C1a C 10.1031 -14.7008
32 O3b O 11.5120 -15.1199
33 O2b O 13.4919 -15.1199
34 C8y C 13.1309 -13.7723
35 C8y C 14.1262 -12.7769
36 C8y C 13.7638 -11.4246
37 C8x C 12.4114 -11.0623
38 C8x C 11.4161 -12.0578
39 C8x C 11.7785 -13.4101
40 C8x C 15.4785 -13.1391
41 C8x C 16.4684 -12.1491
42 C8x C 16.1060 -10.7968
43 C8x C 14.7536 -10.4346
BOND 47
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 5 6 1 #Down
6 4 5 1
7 1 7 1 #Up
8 8 7 1
9 9 10 1
10 10 11 1
11 11 12 1
12 8 12 2
13 12 13 1
14 11 14 2
15 9 15 2
16 9 7 1
17 4 16 1 #Up
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 21 23 2
25 22 24 1
26 24 25 1
27 25 26 2
28 26 27 1
29 27 28 2
30 28 29 1
31 29 30 2
32 25 30 1
33 20 31 1 #Down
34 18 32 2
35 18 33 1
36 33 34 1
37 34 35 2
38 35 36 1
39 36 37 2
40 37 38 1
41 38 39 2
42 34 39 1
43 35 40 1
44 40 41 2
45 41 42 1
46 42 43 2
47 36 43 1
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|---|
