KEGG   DRUG: Tiratricol
Entry
D07214                      Drug                                   

Name
Tiratricol (INN);
Tiracana (TN)
Formula
C14H9I3O4
Exact mass
621.7635
Mol weight
621.9323
Structure
Simcomp
Class
Endocrine and hormonal agent
 DG01953  Thyroid preparation
  DG01608  Thyroid hormone replenisher
Remark
ATC code: D11AX08 H03AA04
Efficacy
Replenisher (thyroid hormone)
Comment
thyroid hormone analog
Target
NR1A (THR) [HSA:7067 7068] [KO:K05547 K08362]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04919  Thyroid hormone signaling pathway
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D11 OTHER DERMATOLOGICAL PREPARATIONS
   D11A OTHER DERMATOLOGICAL PREPARATIONS
    D11AX Other dermatologicals
     D11AX08 Tiratricol
      D07214  Tiratricol (INN)
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H03 THYROID THERAPY
   H03A THYROID PREPARATIONS
    H03AA Thyroid hormones
     H03AA04 Tiratricol
      D07214  Tiratricol (INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Thyroid hormone like receptors
   Thyroid hormone receptor (THR)
    NR1A (THR)
     D07214  Tiratricol (INN)
Other DBs
CAS: 51-24-1
PubChem: 51091552
ChEMBL: CHEMBL41632
PDB-CCD: 4HY[PDBj]
LigandBox: D07214
NIKKAJI: J4.113K
LinkDB
KCF data

ATOM        21
            1   O2a O    15.7500  -14.6300
            2   C8y C    14.5600  -13.9300
            3   C8y C    14.5600  -12.5300
            4   C8x C    13.3000  -11.8300
            5   C8y C    12.1100  -12.5300
            6   C8x C    12.1100  -13.9300
            7   C8y C    13.3000  -14.6300
            8   X   I    13.3000  -16.0300
            9   X   I    15.7500  -11.8300
            10  C1b C    10.9200  -11.8300
            11  C6a C     9.7300  -12.5300
            12  O6a O     8.5400  -11.8300
            13  O6a O     9.7300  -13.9300
            14  C8y C    16.9624  -15.3300
            15  C8x C    16.9624  -16.7298
            16  C8x C    18.1749  -17.4298
            17  C8y C    19.3873  -16.7298
            18  C8y C    19.3873  -15.3300
            19  C8x C    18.1749  -14.6300
            20  O1a O    20.6018  -17.4310
            21  X   I    20.6018  -14.6288
BOND        22
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     6   7 2
            7     2   7 1
            8     7   8 1
            9     3   9 1
            10    5  10 1
            11   10  11 1
            12   11  12 1
            13   11  13 2
            14    1  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   14  19 1
            21   17  20 1
            22   18  21 1

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