COMPOUND: C11932
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Entry
C11932 Compound
Name
dTDP-2,6-dideoxy-L-erythro-hexos-3-ulose;
dTDP 1-ester with 2,6-dideoxy-L-erythro-hexopyranos-3-ulose
Formula
C16H24N2O14P2
Exact mass
530.0703
Mol weight
530.3143
Structure
Mol file
KCF file
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Other DBs
PubChem:
14093
ChEBI:
29717
3DMET:
B05575
NIKKAJI:
J2.777.844E
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KCF data
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ATOM 34
1 C1y C 27.0069 -15.6497
2 N4y N 28.3475 -15.2089
3 O2x O 25.9067 -14.8476
4 C1x C 26.5886 -17.0283
5 C8y C 29.4020 -16.1510
6 C8x C 28.6414 -13.8345
7 C1y C 24.7580 -15.6834
8 C1y C 25.1798 -17.0283
9 N4x N 30.7504 -15.7023
10 O5x O 29.1272 -17.5218
11 C8y C 29.9707 -13.3859
12 C1b C 23.4209 -15.2503
13 O1a O 24.3474 -18.1587
14 C8y C 31.0366 -14.3238
15 C1a C 30.2457 -12.0074
16 O2b O 22.3817 -16.1882
17 O5x O 32.3736 -13.8830
18 P1b P 20.9765 -16.1882
19 O2c O 19.5753 -16.1882
20 O1c O 20.9728 -17.5936
21 O1c O 20.9728 -14.7914
22 P1b P 18.1706 -16.1882
23 O2b O 16.7696 -16.1882
24 O1c O 18.1630 -17.5936
25 O1c O 18.1630 -14.7914
26 C1y C 15.5795 -16.8780
27 C1x C 15.5682 -18.2600
28 O2x O 14.3892 -16.1848
29 C5x C 14.3667 -18.9454
30 C1y C 13.1877 -16.8588
31 C1y C 13.1765 -18.2452
32 O5x O 14.3554 -20.3508
33 C1a C 12.0009 -16.1735
34 O1a O 11.9560 -18.9307
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 2
32 30 33 1 #Down
33 31 34 1 #Up
34 7 8 1
35 11 14 1
36 30 31 1
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