COMPOUND: C22575
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Entry
C22575 Compound
Name
UDP-2-acetamido-4-amino-2,4,6-trideoxy-D-galactose
Formula
C17H28N4O15P2
Exact mass
590.1026
Mol weight
590.3695
Structure
Mol file
KCF file
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Reaction
R13087
Pathway
map00541
O-Antigen nucleotide sugar biosynthesis
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KCF data
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ATOM 38
1 C1y C 24.5390 -17.3890
2 N4y N 25.6063 -15.1672
3 O2x O 23.4195 -16.5725
4 C1y C 24.1367 -18.6602
5 C8y C 24.4283 -14.4674
6 C8x C 26.8075 -14.4674
7 C1y C 22.3291 -17.3656
8 C1y C 22.7664 -18.6602
9 O1a O 24.9356 -19.7682
10 N4x N 24.4283 -13.0855
11 O5x O 23.2445 -15.1439
12 C8x C 26.8075 -13.0855
13 C1b C 21.0287 -16.9457
14 O1a O 21.9676 -19.7739
15 C8y C 25.6120 -12.3974
16 O2b O 20.7429 -15.6162
17 O5x O 25.6063 -11.0445
18 P1b P 19.3726 -15.6105
19 O2c O 18.0021 -15.6105
20 O1c O 19.3726 -14.2459
21 O1c O 19.3666 -16.9750
22 P1b P 16.6435 -15.6105
23 O2b O 15.2730 -15.6105
24 O1c O 16.6435 -14.2459
25 O1c O 16.6435 -16.9750
26 C1y C 14.0951 -16.2869
27 C1y C 14.0951 -17.6689
28 O2x O 12.8938 -15.6105
29 C1y C 12.8938 -18.3686
30 N1b N 15.2380 -18.5087
31 C1y C 11.7100 -16.2869
32 C1y C 11.7100 -17.6689
33 O1a O 12.8880 -19.7391
34 C5a C 16.2236 -19.5000
35 C1a C 10.5262 -15.6105
36 N1a N 10.5205 -18.3512
37 C1a C 16.2178 -20.8936
38 O5a O 17.4364 -18.7885
BOND 40
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 4 9 1 #Down
9 5 10 1
10 5 11 2
11 6 12 2
12 7 13 1 #Up
13 8 14 1 #Down
14 10 15 1
15 13 16 1
16 15 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 27 30 1 #Down
30 28 31 1
31 29 32 1
32 29 33 1 #Up
33 30 34 1
34 31 35 1 #Up
35 32 36 1 #Up
36 34 37 1
37 34 38 2
38 7 8 1
39 12 15 1
40 31 32 1
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