COMPOUND: C06622
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Entry
C06622 Compound
Name
dTDP-4-oxo-2,6-dideoxy-L-allose
Formula
C16H24N2O14P2
Exact mass
530.0703
Mol weight
530.3143
Structure
Mol file
KCF file
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Other DBs
PubChem:
8848
ChEBI:
28176
NIKKAJI:
J2.762.504E
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KCF data
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ATOM 34
1 C1y C 29.6929 -16.9056
2 N4y N 31.0566 -16.5326
3 O2x O 28.5622 -16.0955
4 C1x C 29.2675 -18.2284
5 C8y C 32.0648 -17.5233
6 C8x C 31.4121 -15.1629
7 C1y C 27.4491 -16.9056
8 C1y C 27.8688 -18.2284
9 N4x N 33.4228 -17.1446
10 O5x O 31.6801 -18.8811
11 C8y C 32.7758 -14.7842
12 C1b C 26.1204 -16.4626
13 O1a O 27.0411 -19.3591
14 C8y C 33.7782 -15.7749
15 C1a C 33.1314 -13.4147
16 O2b O 25.0830 -17.4010
17 O5x O 35.1419 -15.3962
18 P1b P 23.6902 -17.4010
19 O2c O 22.2972 -17.4010
20 O1c O 23.6902 -18.7880
21 O1c O 23.6902 -16.0022
22 P1b P 20.9102 -17.4010
23 O2b O 19.5057 -17.3834
24 O1c O 20.9102 -18.7880
25 O1c O 20.9102 -16.0022
26 C1y C 18.2410 -18.0770
27 C1x C 18.2993 -19.4698
28 O2x O 17.1046 -17.3660
29 C1y C 17.0872 -20.1575
30 C1y C 15.8925 -18.0537
31 C5x C 15.8808 -19.4465
32 O1a O 17.0755 -21.5795
33 C1a C 14.6977 -17.3543
34 O5x O 14.6511 -20.1401
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 29 32 1 #Up
32 30 33 1 #Down
33 31 34 2
34 7 8 1
35 11 14 1
36 30 31 1
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