| Entry |
|
|---|
| Name |
6-Thioinosine-5'-monophosphate;
9-(5-Phospho-1-ribofuranosyl)-6-mercaptopurine
|
|---|
| Formula |
C10H13N4O7PS
|
|---|
| Exact mass |
364.0243
|
|---|
| Mol weight |
364.27
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00983 | Drug metabolism - other enzymes |
|
|---|
| Enzyme |
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 23
1 N4y N 27.9300 -17.8500
2 C8y C 29.2600 -17.4300
3 C1y C 26.2500 -18.6900
4 C8x C 27.0900 -16.7300
5 C8y C 29.2600 -16.0300
6 N5x N 30.4500 -18.0600
7 O2x O 25.1300 -17.8500
8 C1y C 25.8300 -19.9500
9 N5x N 27.9300 -15.6100
10 C8y C 30.4500 -15.3300
11 C8x C 31.6400 -17.4300
12 C1y C 24.0100 -18.6900
13 C1y C 24.4300 -19.9500
14 O1a O 26.6000 -21.0000
15 N5x N 31.6400 -16.0300
16 S1a S 30.4500 -14.1400
17 C1b C 22.6800 -18.2700
18 O1a O 23.5900 -21.0000
19 O2b O 22.4700 -16.8700
20 P1b P 21.0700 -16.8700
21 O1c O 19.6700 -16.8700
22 O1c O 21.0700 -15.5400
23 O1c O 21.0700 -18.2700
BOND 25
1 1 2 1
2 3 1 1 #Up
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 1
12 8 13 1
13 8 14 1 #Down
14 10 15 2
15 10 16 1
16 12 17 1 #Up
17 13 18 1 #Down
18 17 19 1
19 19 20 1
20 20 21 1
21 20 22 1
22 20 23 2
23 5 9 1
24 11 15 1
25 12 13 1
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