KEGG   COMPOUND: C01060Help
Entry
C01060                      Compound                               

Name
3,5-Diiodo-L-tyrosine;
3,5-Diiodotyrosine;
L-Diiodotyrosine
Formula
C9H9I2NO3
Exact mass
432.8672
Mol weight
432.9816
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
ATC code: 
Reaction
Pathway
Tyrosine metabolism
Metabolic pathways
Thyroid hormone synthesis
Enzyme
1.11.1.8        1.22.1.1        2.6.1.24
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Other amino acids
    C01060  3,5-Diiodo-L-tyrosine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H03 THYROID THERAPY
   H03B ANTITHYROID PREPARATIONS
    H03BX Other antithyroid preparations
     H03BX01 Diiodotyrosine
      C01060  3,5-Diiodo-L-tyrosine
BRITE hierarchy
Other DBs
CAS: 
300-39-0 66-02-4
PubChem: 
ChEBI: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        15
            1   C8y C    26.2673  -15.1382
            2   C8x C    26.2673  -16.5420
            3   C8x C    27.4847  -14.4392
            4   C1b C    25.0615  -14.4508
            5   C8y C    27.4847  -17.2410
            6   C8y C    28.6963  -15.1382
            7   C1c C    23.8499  -15.1439
            8   C8y C    28.6963  -16.5420
            9   X   I    27.4847  -18.6449
            10  X   I    29.9080  -14.4449
            11  C6a C    22.6325  -14.4508
            12  N1a N    23.8499  -16.5479
            13  O1a O    29.9080  -17.2410
            14  O6a O    21.4208  -15.1439
            15  O6a O    22.6325  -13.0470
BOND        15
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     4   7 1
            7     5   8 2
            8     5   9 1
            9     6  10 1
            10    7  11 1
            11    7  12 1 #Down
            12    8  13 1
            13   11  14 1
            14   11  15 2
            15    6   8 1

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