COMPOUND: C16730
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Entry
C16730 Compound
Name
Thyroglobulin triiodothyronine;
[Thyroglobulin]-3,5,3'-triiodo-L-thyronine
Formula
C16H11I3N2O4R2
Structure
Mol file
KCF file
DB search
Comment
Generic compound in reaction hierarchy
Prohormone of Triiodothyronine [CPD:
C02465
]
Reaction
R08522
R08524
Enzyme
1.11.1.8
Other DBs
PubChem:
96023254
ChEBI:
80690
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All DBs
KCF data
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ATOM 27
1 C8y C 30.8193 -22.0831
2 O2a O 29.6135 -21.3782
3 C8x C 30.8193 -23.4811
4 C8x C 32.0367 -21.3782
5 C8y C 28.4019 -20.6792
6 C8x C 32.0367 -24.1801
7 C8y C 33.2483 -22.0831
8 C8y C 27.1961 -21.3782
9 C8y C 28.4019 -19.2813
10 C8y C 33.2483 -23.4811
11 X I 34.4598 -21.3782
12 C8x C 25.9788 -20.6792
13 X I 27.1961 -22.7762
14 C8x C 27.1961 -18.5764
15 X I 29.6193 -18.5764
16 O1a O 34.4598 -24.1742
17 C8y C 25.9788 -19.2813
18 C1b C 24.7615 -18.5823
19 C1c C 23.5498 -19.2813
20 C5a C 22.3324 -18.5823
21 N1b N 23.5498 -20.6792
22 N1b N 21.1209 -19.2813
23 O5a O 22.3324 -17.1843
24 R R 19.9085 -18.5813
25 C5a C 22.3374 -21.3792
26 O5a O 21.1249 -20.6792
27 R R 22.3374 -22.7792
BOND 28
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 3 6 1
6 4 7 2
7 5 8 2
8 5 9 1
9 6 10 2
10 7 11 1
11 8 12 1
12 8 13 1
13 9 14 2
14 9 15 1
15 10 16 1
16 12 17 2
17 17 18 1
18 18 19 1
19 19 20 1
20 19 21 1 #Down
21 20 22 1
22 20 23 2
23 7 10 1
24 14 17 1
25 22 24 1
26 21 25 1
27 25 26 2
28 25 27 1
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