Indoxyl sulfate potassium salt - CAS 2642-37-7

Catalog:	BB019275
Product Name:	Indoxyl sulfate potassium salt
CAS:	2642-37-7
Synonyms:	potassium;1H-indol-3-yl sulfate

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	potassium;1H-indol-3-yl sulfate
Description:	Indoxyl sulfate potassium salt (CAS# 2642-37-7) is a sensitive and early biomarker of nephrotoxicity.
Molecular Weight:	251.30
Molecular Formula:	C8H6KNO4S
Canonical SMILES:	C1=CC=C2C(=C1)C(=CN2)OS(=O)(=O)[O-].[K+]
InChI:	InChI=1S/C8H7NO4S.K/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8;/h1-5,9H,(H,10,11,12);/q;+1/p-1
InChI Key:	MDAWATNFDJIBBD-UHFFFAOYSA-M
Appearance:	White to off-white crystalline powder
MDL:	MFCD00037931
LogP:	2.08770

Publication Number	Title	Priority Date
WO-2020126625-A1	P450 split enzyme as well as products, methods and uses relating thereto	20181219
WO-2020086496-A1	Metal-organic frameworks for the removal of uremic toxins	20181023
WO-2020064054-A1	Method, apparatus and indicator for localization of overheating damage	20180924
EP-3857220-A1	Method, apparatus and indicator for localization of overheating damage	20180924
AU-2017382744-A1	Mass spectrometry assay method for detection and quantitation of kidney function metabolites	20161219

PMID	Publication Date	Title	Journal
5014	19751201	[Physico-chemical characteristics, absorption and elimination kinetics and technics of use of enflurane]	Annales de l'anesthesiologie francaise

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Complexity:	302
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	250.96546033
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	250.96546033
Rotatable Bond Count:	2
Topological Polar Surface Area:	90.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0