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7-HYDROXY COUMARIN GLUCURONIDE

CAS No.:
66695-14-5
Catalog Number:
AG00FA25
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00FA25
Chemical Name:
7-HYDROXY COUMARIN GLUCURONIDE
CAS Number:
66695-14-5
MDL Number:
MFCD01311880
IUPAC Name:
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-oxochromen-7-yl)oxyoxane-2-carboxylic acid
InChI:
InChI=1S/C15H14O9/c16-9-4-2-6-1-3-7(5-8(6)23-9)22-15-12(19)10(17)11(18)13(24-15)14(20)21/h1-5,10-13,15,17-19H,(H,20,21)/t10-,11-,12+,13-,15+/m0/s1
InChI Key:
PRYLPCLGPXGILY-DKBOKBLXSA-N
Properties
Complexity:
533  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
338.064g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
338.268g/mol
Monoisotopic Mass:
338.064g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
143A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
Title Journal
Transport of the coumarin metabolite 7-hydroxycoumarin glucuronide is mediated via multidrug resistance-associated proteins 3 and 4. Drug metabolism and disposition: the biological fate of chemicals 20120601
On-line HPLC analysis system for metabolism and inhibition studies in precision-cut liver slices. Analytical chemistry 20110101
Artemisinin and CYP2A6 activity in healthy subjects. European journal of clinical pharmacology 20080301
Selective effects of nitric oxide on the disposition of chlorzoxazone and dextromethorphan in isolated perfused rat livers. Drug metabolism and disposition: the biological fate of chemicals 20060701
Glucuronidation and sulfation of 7-hydroxycoumarin in liver matrices from human, dog, monkey, rat, and mouse. In vitro cellular & developmental biology. Animal 20050101
Cloning and expression of a rat liver phenobarbital-inducible UDP-glucuronosyltransferase (2B12) with specificity for monoterpenoid alcohols. Archives of biochemistry and biophysics 19951001
Stable expression of a human liver UDP-glucuronosyltransferase (UGT2B15) with activity toward steroid and xenobiotic substrates. Drug metabolism and disposition: the biological fate of chemicals 19940101
Properties