KEGG   COMPOUND: C16730
Entry
C16730                      Compound                               
Name
Thyroglobulin triiodothyronine;
[Thyroglobulin]-3,5,3'-triiodo-L-thyronine
Formula
C16H11I3N2O4R2
Structure
Comment
Generic compound in reaction hierarchy
Prohormone of Triiodothyronine [CPD:C02465]
Reaction
Enzyme
Other DBs
PubChem: 96023254
ChEBI: 80690
KCF data

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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