COMPOUND: C21395
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Entry
C21395 Compound
Name
dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-D-glucose;
dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranose
Formula
C17H29N3O12P2
Exact mass
529.1226
Mol weight
529.3726
Structure
Mol file
KCF file
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Reaction
R11452
R11453
Enzyme
2.1.1.324
Other DBs
PubChem:
328082938
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KCF data
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ATOM 34
1 C1y C 24.0231 -15.7588
2 N4y N 25.3535 -15.2686
3 O2x O 22.9027 -14.9185
4 C1x C 23.6030 -17.0893
5 C8y C 26.4039 -16.2490
6 C8x C 25.6336 -13.9382
7 C1y C 21.7823 -15.7588
8 C1y C 22.2025 -17.0893
9 N4x N 27.8044 -15.7588
10 O5x O 26.1238 -17.5794
11 C8y C 26.9641 -13.4480
12 C1b C 20.5219 -15.3387
13 O1a O 21.4322 -18.2096
14 C8y C 28.0845 -14.4284
15 C1a C 27.2442 -12.0475
16 O2b O 19.4715 -16.2490
17 O5x O 29.4149 -13.9382
18 P1b P 18.0711 -16.2490
19 O2c O 16.6706 -16.2490
20 O1c O 18.0711 -17.6495
21 O1c O 18.0711 -14.8485
22 P1b P 15.2701 -16.2490
23 O2b O 13.8696 -16.2490
24 O1c O 15.2701 -17.6495
25 O1c O 15.2701 -14.8485
26 C1y C 12.6792 -16.9492
27 C1x C 12.6792 -18.3497
28 O2x O 11.4888 -16.2490
29 C1x C 11.4188 -19.0499
30 C1y C 10.2284 -16.9492
31 C1y C 10.2284 -18.3497
32 C1a C 9.0380 -16.2490
33 N1b N 9.0380 -18.9799
34 C1a C 7.8517 -18.2357
BOND 36
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 2
10 6 11 2
11 7 12 1 #Up
12 8 13 1 #Down
13 9 14 1
14 11 15 1
15 12 16 1
16 14 17 2
17 16 18 1
18 18 19 1
19 18 20 1
20 18 21 2
21 19 22 1
22 22 23 1
23 22 24 1
24 22 25 2
25 26 23 1 #Down
26 26 27 1
27 26 28 1
28 27 29 1
29 28 30 1
30 29 31 1
31 30 32 1 #Up
32 31 33 1 #Down
33 7 8 1
34 11 14 1
35 30 31 1
36 33 34 1
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