COMPOUND: C21384
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Entry
C21384 Compound
Name
CMP-3-deoxy-D-glycero-D-galacto-non-2-ulopyranosonate;
CMP-2-keto-3-deoxy-D-glycero-D-galacto-nononate;
CMP-3-deoxy-D-glycero-beta-D-galacto-non-2-ulosonate;
CMP-KDN
Formula
C18H28N3O16P
Exact mass
573.1207
Mol weight
573.3992
Structure
Mol file
KCF file
DB search
Reaction
R11441
Pathway
map00520
Amino sugar and nucleotide sugar metabolism
map01100
Metabolic pathways
map01250
Biosynthesis of nucleotide sugars
Enzyme
2.7.7.92
Other DBs
PubChem:
328082927
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KCF data
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ATOM 38
1 C1z C 15.3934 -16.0804
2 O2x O 14.2512 -15.4190
3 C1x C 15.3934 -17.3946
4 O2b O 17.4894 -17.6555
5 C6a C 16.5222 -15.4190
6 C1y C 13.1109 -16.0804
7 C1y C 14.2512 -18.0731
8 P1b P 18.8107 -17.6555
9 O6a O 16.4932 -14.1106
10 O6a O 17.6515 -16.0804
11 C1y C 13.1109 -17.3946
12 O1a O 14.2571 -19.3759
13 O2b O 20.1136 -17.6555
14 O1c O 18.8107 -19.1038
15 O1c O 18.8107 -16.1324
16 C1b C 21.4291 -17.6555
17 C1y C 22.6744 -18.0443
18 O2x O 23.7346 -17.2727
19 C1y C 23.0918 -19.2896
20 C1y C 24.8119 -18.0615
21 C1y C 24.4245 -19.2896
22 O1a O 22.3386 -20.3556
23 N4y N 25.6468 -15.8652
24 O1a O 25.1948 -20.3441
25 C8y C 24.4991 -15.1995
26 C8x C 26.7933 -15.2225
27 N5x N 24.4590 -13.8841
28 O5x O 23.3700 -15.8478
29 C8x C 26.7933 -13.8898
30 C8y C 25.6526 -13.2239
31 N1a N 25.6526 -11.9141
32 C1c C 11.9124 -15.3677
33 C1c C 11.9173 -13.9912
34 C1b C 10.7276 -13.2989
35 O1a O 10.7324 -11.9224
36 O1a O 11.7017 -18.3548
37 O1a O 13.1021 -13.3071
38 O1a O 10.7105 -16.0485
BOND 40
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 1 5 1 #Down
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 2
10 6 11 1
11 7 12 1 #Down
12 8 13 1
13 8 14 1
14 8 15 2
15 13 16 1
16 17 16 1 #Up
17 17 18 1
18 17 19 1
19 18 20 1
20 19 21 1
21 19 22 1 #Down
22 20 23 1 #Up
23 21 24 1 #Down
24 23 25 1
25 23 26 1
26 25 27 1
27 25 28 2
28 26 29 2
29 27 30 2
30 30 31 1
31 7 11 1
32 20 21 1
33 29 30 1
34 6 32 1
35 32 33 1
36 33 34 1
37 34 35 1
38 11 36 1 #Up
39 33 37 1 #Up
40 32 38 1 #Down
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