IH5
{3,5-DICHLORO-4-[4-HYDROXY-3-(PROPAN-2-YL)PHENOXY]PHENYL}ACETIC ACID
Find entries where: IH5
is present as a standalone ligand in 2 entries
Chemical Component Summary | |
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Name | {3,5-DICHLORO-4-[4-HYDROXY-3-(PROPAN-2-YL)PHENOXY]PHENYL}ACETIC ACID |
Synonyms | 3,5-DICHLORO-4-[(4-HYDROXY-3-ISOPROPYLPHENOXY)PHENYL]ACETIC ACID |
Identifiers | 2-[3,5-bis(chloranyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]ethanoic acid |
Formula | C17 H16 Cl2 O4 |
Molecular Weight | 355.213 |
Type | NON-POLYMER |
Isomeric SMILES | CC(C)c1cc(ccc1O)Oc2c(cc(cc2Cl)CC(=O)O)Cl |
InChI | InChI=1S/C17H16Cl2O4/c1-9(2)12-8-11(3-4-15(12)20)23-17-13(18)5-10(6-14(17)19)7-16(21)22/h3-6,8-9,20H,7H2,1-2H3,(H,21,22) |
InChIKey | OZYQIQVPUZANTM-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 39 |
Chiral Atom Count | 0 |
Bond Count | 40 |
Aromatic Bond Count | 12 |
Drug Info: DrugBank
DrugBank ID | DB03176 |
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Name | KB-141 |
Groups | experimental |
Description | An anticholesteremic agent. |
Synonyms |
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Categories |
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CAS number | 219691-94-8 |
Drug Targets
Name | Target Sequence | Pharmacological Action | Actions |
---|---|---|---|
Thyroid hormone receptor alpha | MEQKPSKVECGSDPEENSARSPDGKRKRKNGQCSLKTSMSGYIPSYLDKD... | unknown | |
Thyroid hormone receptor beta | MTPNSMTENGLTAWDKPKHCPDREHDWKLVGMSEACLHRKSHSERRSTLK... | unknown |
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison
T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS.
Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682
Related Resource References
Resource Name | Reference |
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Pharos | CHEMBL41036 |
PubChem | 9863447 |
ChEMBL | CHEMBL41036 |