4KS

4-methoxyphenol

Created:	2015-04-01
Last modified:	2016-04-13

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1 entries where 4KS is found as a standalone ligand3 entries where 4KS is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	17
Chiral Atom Count	0
Bond Count	17
Aromatic Bond Count	6

2D diagram of 4KS

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Chemical Component Summary
Name	4-methoxyphenol
Systematic Name (OpenEye OEToolkits)	4-methoxyphenol
Formula	C₇ H₈ O₂
Molecular Weight	124.137
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1(O)ccc(cc1)OC
SMILES	CACTVS	3.385	COc1ccc(O)cc1
SMILES	OpenEye OEToolkits	1.9.2	COc1ccc(cc1)O
Canonical SMILES	CACTVS	3.385	COc1ccc(O)cc1
Canonical SMILES	OpenEye OEToolkits	1.9.2	COc1ccc(cc1)O
InChI	InChI	1.03	InChI=1S/C7H8O2/c1-9-7-4-2-6(8)3-5-7/h2-5,8H,1H3
InChIKey	InChI	1.03	NWVVVBRKAWDGAB-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB09516
Name	Mequinol
Groups	approved
Description	Mequinol is a phenol used in various applications. It is used as an inhibitor for acrylic monomers and acrylonitirles, as a stabilizer for chlorinated hydrocarbons and ethyl cellulose, as an ultraviolet inhibitor, as a chemical intermediate in the manufacture of antioxidants, pharmaceuticals, plasticizers, and dyestuffs [L993]. It is found as an active ingredient in topical drugs used for skin depigmentation indicated for the treatment of solar lentigines.
Synonyms	4-Methoxyphenol Mequinol
Brand Names	Solage Solagé
Indication	Mequinol is currently primarily available only as an active ingredient in combination products combined with tretinoin that are indicated for the treatment of solar lentigines and related hyperpigmented lesions resulting from chronic sun exposure [FDA Label].
Categories	Antioxidants Benzene Derivatives Biological Factors Compounds used in a research, industrial, or household setting Depigmenting Agents Dermatologicals Ethers Lentigo Melanin Synthesis Inhibitors Methyl Ethers Phenols Phenyl Ethers Protective Agents Skin Lightening Agent
ATC-Code	D11AX06
CAS number	150-76-5

Related Resource References

Resource Name	Reference
Pharos	CHEMBL544
PubChem	9015
ChEMBL	CHEMBL544
ChEBI	CHEBI:69441
CCDC/CSD	BAYNIA, MOPHLC, ZAPFEB, XADQUO, ACEBAP

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.