COMPOUND: C21074
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Entry
C21074 Compound
Name
dTDP-3-N,N-dimethylamino-4-oxo-2,3,6-trideoxy-L-allose;
dTDP-3-N,N-dimethylamino-4-keto-2,3,6-trideoxy-L-allose
Formula
C18H29N3O13P2
Exact mass
557.1176
Mol weight
557.38
Structure
Mol file
KCF file
DB search
Reaction
R11046
R11047
Pathway
map00523
Polyketide sugar unit biosynthesis
map01100
Metabolic pathways
map01110
Biosynthesis of secondary metabolites
map01250
Biosynthesis of nucleotide sugars
Module
M00800
dTDP-L-megosamine biosynthesis
Enzyme
5.1.3.-
Other DBs
PubChem:
295369336
LinkDB
All DBs
KCF data
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ATOM 36
1 N4y N 25.2689 -14.7401
2 C8y C 24.0793 -14.0345
3 C8x C 26.4759 -14.0345
4 N4x N 24.0793 -12.6468
5 O5x O 22.8900 -14.7168
6 C8y C 26.4759 -12.6468
7 C8y C 25.2689 -11.9531
8 C1a C 27.6535 -11.9531
9 O5x O 25.2689 -10.5888
10 C1y C 24.6959 -16.3305
11 O2x O 23.6078 -15.5363
12 C1x C 24.2841 -17.7122
13 C1y C 22.4578 -16.3772
14 C1y C 22.8776 -17.7122
15 C1b C 21.1214 -15.9386
16 O1a O 22.0496 -18.8389
17 O2b O 20.0766 -16.8786
18 P1b P 18.6761 -16.8786
19 O2c O 17.2754 -16.8786
20 O1c O 18.6702 -18.2792
21 O1c O 18.6702 -15.4780
22 P1b P 15.8691 -16.8786
23 O2b O 14.4686 -16.8786
24 O1c O 15.8633 -18.2792
25 O1c O 15.8633 -15.4780
26 C1y C 13.2779 -17.5607
27 C1x C 13.2663 -18.9439
28 O2x O 12.0873 -16.8728
29 C1y C 12.0641 -19.6329
30 C1y C 10.8921 -17.5431
31 C5x C 10.8804 -18.9263
32 N1c N 12.0524 -21.0335
33 C1a C 9.7072 -16.8611
34 O5x O 9.6607 -19.6154
35 C1a C 10.8097 -21.7369
36 C1a C 13.2558 -21.7421
BOND 38
1 2 4 1
2 2 5 2
3 3 6 2
4 4 7 1
5 6 8 1
6 7 9 2
7 6 7 1
8 10 1 1 #Up
9 1 2 1
10 1 3 1
11 10 11 1
12 10 12 1
13 11 13 1
14 12 14 1
15 13 15 1 #Up
16 14 16 1 #Down
17 15 17 1
18 17 18 1
19 18 19 1
20 18 20 1
21 18 21 2
22 19 22 1
23 22 23 1
24 22 24 1
25 22 25 2
26 26 23 1 #Down
27 26 27 1
28 26 28 1
29 27 29 1
30 28 30 1
31 29 31 1
32 29 32 1 #Up
33 30 33 1 #Down
34 31 34 2
35 13 14 1
36 30 31 1
37 32 35 1
38 32 36 1
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