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Details

Stereochemistry RACEMIC
Molecular Formula C15H13Cl3O2
Molecular Weight 331.622
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MONODEMETHYLMETHOXYCHLOR

SMILES

COC1=CC=C(C=C1)C(C2=CC=C(O)C=C2)C(Cl)(Cl)Cl

InChI

InChIKey=BUZUQNXGKRJIJT-UHFFFAOYSA-N
InChI=1S/C15H13Cl3O2/c1-20-13-8-4-11(5-9-13)14(15(16,17)18)10-2-6-12(19)7-3-10/h2-9,14,19H,1H3

HIDE SMILES / InChI

Molecular Formula C15H13Cl3O2
Molecular Weight 331.622
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Catalytic characteristics of CYP3A4: requirement for a phenolic function in ortho hydroxylation of estradiol and mono-O-demethylated methoxychlor.
1997 Feb 25
Prosubstrates of CYP3A4, the major human hepatic cytochrome P450: transformation into substrates by other P450 isoforms.
1998 Jun 1
Human cytochrome P450-catalyzed conversion of the proestrogenic pesticide methoxychlor into an estrogen. Role of CYP2C19 and CYP1A2 in O-demethylation.
1998 Sep
Mechanism of induction of cytochrome p450 enzymes by the proestrogenic endocrine disruptor pesticide-methoxychlor: interactions of methoxychlor metabolites with the constitutive androstane receptor system.
2001 Jun
Enantioselective metabolism of the endocrine disruptor pesticide methoxychlor by human cytochromes P450 (P450s): major differences in selective enantiomer formation by various P450 isoforms.
2002 Dec
Metabolism of the endocrine disruptor pesticide-methoxychlor by human P450s: pathways involving a novel catechol metabolite.
2002 Sep
Enantioselective recognition of mono-demethylated methoxychlor metabolites by the estrogen receptor.
2004 Feb
Sulfonation of environmental chemicals and their metabolites in the polar bear (Ursus maritimus).
2005 Sep
Methoxychlor metabolites may cause ovarian toxicity through estrogen-regulated pathways.
2006 Sep
Stimulation of transactivation of the largemouth bass estrogen receptors alpha, beta-a, and beta-b by methoxychlor and its mono- and bis-demethylated metabolites in HepG2 cells.
2008 Jan
Influence of dietary Coexposure to benzo(a)pyrene on the biotransformation and distribution of 14C-methoxychlor in the channel catfish (Ictalurus punctatus).
2009 Apr
Mono-hydroxy methoxychlor alters levels of key sex steroids and steroidogenic enzymes in cultured mouse antral follicles.
2010 Dec 1
Increased sensitivity of estrogen receptor alpha overexpressing antral follicles to methoxychlor and its metabolites.
2011 Apr
Estrogen receptor alpha overexpressing mouse antral follicles are sensitive to atresia induced by methoxychlor and its metabolites.
2012 Jun
Substance Class Chemical
Created
by admin
on Sat Dec 16 05:03:07 GMT 2023
Edited
by admin
on Sat Dec 16 05:03:07 GMT 2023
Record UNII
Y8I9CWQ645
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MONODEMETHYLMETHOXYCHLOR
Common Name English
1,1,1-TRICHLORO-2-(4-HYDROXYPHENYL)-2-(4-METHOXYPHENYL)ETHANE
Systematic Name English
PHENOL, P-(P-METHOXY-.ALPHA.-(TRICHLOROMETHYL)BENZYL)-
Common Name English
2-(4-METHOXYPHENYL)-2-(4-HYDROXYPHENYL)-1,1,1-TRICHLOROETHANE
Systematic Name English
PHENOL, 4-(2,2,2-TRICHLORO-1-(4-METHOXYPHENYL)ETHYL)-
Systematic Name English
2-(P-HYDROXYPHENYL)-2-(P-METHOXYPHENYL)-1,1,1-TRICHLOROETHANE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID0022482
Created by admin on Sat Dec 16 05:03:07 GMT 2023 , Edited by admin on Sat Dec 16 05:03:07 GMT 2023
PRIMARY
PUBCHEM
183679
Created by admin on Sat Dec 16 05:03:07 GMT 2023 , Edited by admin on Sat Dec 16 05:03:07 GMT 2023
PRIMARY
CAS
28463-03-8
Created by admin on Sat Dec 16 05:03:07 GMT 2023 , Edited by admin on Sat Dec 16 05:03:07 GMT 2023
PRIMARY
FDA UNII
Y8I9CWQ645
Created by admin on Sat Dec 16 05:03:07 GMT 2023 , Edited by admin on Sat Dec 16 05:03:07 GMT 2023
PRIMARY
Related Record Type Details
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