COMPOUND: C12318
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Entry
C12318 Compound
Name
dTDP-3-amino-2,3,6-trideoxy-4-keto-D-glucose;
dTDP-3-amino-2,3,6-trideoxy-D-threo-hexopyranos-4-ulose;
dTDP-3-amino-4-oxo-2,3,6-trideoxy-D-glucose
Formula
C16H25N3O13P2
Exact mass
529.0863
Mol weight
529.33
Structure
Mol file
KCF file
DB search
Reaction
R06627
R06631
R11045
R11138
Pathway
map00404
Staurosporine biosynthesis
map00523
Polyketide sugar unit biosynthesis
map01055
Biosynthesis of vancomycin group antibiotics
map01100
Metabolic pathways
map01110
Biosynthesis of secondary metabolites
map01250
Biosynthesis of nucleotide sugars
Module
M00800
dTDP-L-megosamine biosynthesis
Enzyme
2.1.1.- 2.6.1.-
Other DBs
PubChem:
582708
ChEBI:
32332
NIKKAJI:
J1.464.416D
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All DBs
KCF data
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ATOM 34
1 N4y N 33.8210 -20.2773
2 C8y C 32.6309 -19.5714
3 C8x C 35.0285 -19.5714
4 N4x N 32.6309 -18.1830
5 O5x O 31.4410 -20.2540
6 C8y C 35.0285 -18.1830
7 C8y C 33.8210 -17.4890
8 C1a C 36.2067 -17.4890
9 O5x O 33.8210 -16.1240
10 C1y C 33.2478 -21.8685
11 O2x O 32.1591 -21.0739
12 C1x C 32.8358 -23.2509
13 C1y C 31.0086 -21.9152
14 C1y C 31.4286 -23.2509
15 C1b C 29.6715 -21.4764
16 O1a O 30.6002 -24.3781
17 O2b O 28.6262 -22.4168
18 P1b P 27.2250 -22.4168
19 O2c O 25.8237 -22.4168
20 O1c O 27.2191 -23.8181
21 O1c O 27.2191 -21.0156
22 P1b P 24.4167 -22.4168
23 O2b O 23.0155 -22.4168
24 O1c O 24.4109 -23.8181
25 O1c O 24.4109 -21.0156
26 C1y C 21.8242 -23.0993
27 C1x C 21.8126 -24.4831
28 O2x O 20.6331 -22.4110
29 C1y C 20.6098 -25.1725
30 C1y C 19.4373 -23.0817
31 C5x C 19.4256 -24.4655
32 N1a N 20.5981 -26.5738
33 C1a C 18.2518 -22.3993
34 O5x O 18.2053 -25.1550
BOND 36
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 #Up
34 31 34 2
35 13 14 1
36 30 31 1
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