COMPOUND: C19967
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Entry
C19967 Compound
Name
8-Oxo-dGTP;
8-Oxodeoxyguanosine triphosphate;
8-Oxo-7,8-dihydro-2'-deoxyguanosine 5'-triphosphate
Formula
C10H16N5O14P3
Exact mass
522.9907
Mol weight
523.1804
Structure
Mol file
KCF file
DB search
Reaction
R09832
R12533
Enzyme
3.6.1.55
3.6.1.69
Other DBs
CAS:
139307-94-1
PubChem:
135626433
PDB-CCD:
8DG
[
PDBj
]
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KCF data
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ATOM 32
1 C8y C 33.1182 -27.5538
2 N4y N 32.0601 -26.8057
3 C8y C 34.3516 -26.6361
4 N4x N 33.2527 -28.9742
5 C1y C 30.7684 -27.2323
6 C8y C 32.5395 -25.4146
7 N4x N 33.9832 -25.4203
8 C8y C 35.6082 -27.1972
9 C8y C 34.5794 -29.5527
10 O2x O 29.6344 -26.3732
11 C1x C 30.3358 -28.4832
12 N5x N 35.7660 -28.6818
13 O5x O 36.7189 -26.3673
14 N1a N 34.7315 -30.9382
15 C1y C 28.5238 -27.1738
16 C1y C 28.9563 -28.4832
17 C1b C 27.2027 -26.7355
18 O1a O 28.5063 -29.7984
19 O2b O 26.1565 -27.6707
20 P1b P 24.7594 -27.6707
21 O2c O 23.3625 -27.6707
22 O1c O 24.7536 -29.0677
23 O1c O 24.7536 -26.2738
24 P1b P 21.9657 -27.6648
25 O2c O 20.5628 -27.6648
26 O1c O 21.9540 -29.0619
27 O1c O 21.9540 -26.2621
28 P1b P 19.1657 -27.6532
29 O1c O 19.1599 -29.0560
30 O1c O 17.7687 -27.6473
31 O1c O 19.1599 -26.2562
32 O5x O 31.7379 -24.2852
BOND 34
1 1 2 1
2 1 3 2
3 1 4 1
4 5 2 1 #Up
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 8 12 1
12 8 13 2
13 9 14 1
14 10 15 1
15 11 16 1
16 15 17 1 #Up
17 16 18 1 #Down
18 17 19 1
19 19 20 1
20 20 21 1
21 20 22 1
22 20 23 2
23 21 24 1
24 24 25 1
25 24 26 1
26 24 27 2
27 25 28 1
28 28 29 1
29 28 30 1
30 28 31 2
31 6 7 1
32 9 12 2
33 15 16 1
34 6 32 2
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