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Details

Stereochemistry ABSOLUTE
Molecular Formula 2C20H24N2O2.8H2O.AsH3O4
Molecular Weight 934.9004
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of QUININE ARSENATE

SMILES

C=C[C@@]1([H])CN2CC[C@@]1([H])C[C@@]2([H])[C@@]([H])(c3ccnc4ccc(cc34)OC)O.C=C[C@@]1([H])CN2CC[C@@]1([H])C[C@@]2([H])[C@@]([H])(c3ccnc4ccc(cc34)OC)O.[As](=O)(O)(O)O.O.O.O.O.O.O.O.O

InChI

InChIKey=CDTWVNODIPITIB-QLOUZFAJSA-N
InChI=1S/2C20H24N2O2.AsH3O4.8H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;2-1(3,4)5;;;;;;;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H3,2,3,4,5);8*1H2/t2*13-,14-,19-,20+;;;;;;;;;/m00........./s1

HIDE SMILES / InChI

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula AsH3O4
Molecular Weight 141.943
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H24N2O2
Molecular Weight 324.4175
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Ammonium dihydrogen arsenate is an inorganic compound that has been considered a potential electro-optic material and has been explored by a number of investigators for modulation purposes. Ammonium arsenate is a cancerogenic substance.

Approval Year

PubMed

PubMed

TitleDatePubMed
Pharmacological characterization of multidrug resistant MRP-transfected human tumor cells.
1994 Nov 15
Screening for reproductive toxicity in Fundulus heteroclitus by genetic expression profiling.
1996
Arsenic-induced neural tube defects in mice: alterations in cell cycle gene expression.
1996 Nov-Dec
Inorganic and methylated arsenic compounds induce cell death in murine macrophages via different mechanisms.
1998 Apr
Enhanced transcription factor DNA binding and gene expression induced by arsenite or arsenate in renal slices.
1999 Jul
Purine nucleoside phosphorylase as a cytosolic arsenate reductase.
2002 Nov
Genetic variation in genes associated with arsenic metabolism: glutathione S-transferase omega 1-1 and purine nucleoside phosphorylase polymorphisms in European and indigenous Americans.
2003 Aug
Valproate-induced neural tube defects in folate-binding protein-2 (Folbp2) knockout mice.
2003 Dec
Arsenite and arsenate activate extracellular signal-regulated kinases 1/2 by an epidermal growth factor receptor-mediated pathway in normal human keratinocytes.
2003 Dec
Human 3'-phosphoadenosine 5'-phosphosulfate synthetase (isoform 1, brain): kinetic properties of the adenosine triphosphate sulfurylase and adenosine 5'-phosphosulfate kinase domains.
2004 Apr 13
Glutathione modulates recombinant rat arsenic (+3 oxidation state) methyltransferase-catalyzed formation of trimethylarsine oxide and trimethylarsine.
2004 Dec
Arsenic induced inhibition of delta-aminolevulinate dehydratase activity in rat blood and its response to meso 2,3-dimercaptosuccinic acid and monoisoamyl DMSA.
2004 Mar
Regulation of cytoplasmic stress granules by apoptosis-inducing factor.
2004 Sep 1
Developmentally restricted genetic determinants of human arsenic metabolism: association between urinary methylated arsenic and CYT19 polymorphisms in children.
2005 Jun
Redox regulation of RhoA.
2006 Dec 5
Organic anion transporting polypeptide-C mediates arsenic uptake in HEK-293 cells.
2006 Jul
Glutathione-S-transferase-omega [MMA(V) reductase] knockout mice: enzyme and arsenic species concentrations in tissues after arsenate administration.
2006 Nov 1
Glutathione-dependent reduction of arsenate by glycogen phosphorylase a reaction coupled to glycogenolysis.
2007 Nov
Glutathione-dependent reduction of arsenate by glycogen phosphorylase responsiveness to endogenous and xenobiotic inhibitors.
2007 Nov
Arsenite-induced cytotoxicity in dorsal root ganglion explants.
2008 Apr 15
Effects of inorganic arsenic on the rat and mouse urinary bladder.
2008 Dec
High dietary fat exacerbates arsenic-induced liver fibrosis in mice.
2008 Mar
Effects of endogenous hydrogen peroxide and glutathione on the stability of arsenic metabolites in rat bile.
2008 Oct 1
Mechanism of thiol-supported arsenate reduction mediated by phosphorolytic-arsenolytic enzymes: II. Enzymatic formation of arsenylated products susceptible for reduction to arsenite by thiols.
2009 Aug
Effects of different inorganic arsenic species in Cyprinus carpio (Cyprinidae) tissues after short-time exposure: bioaccumulation, biotransformation and biological responses.
2009 Dec
Fast, quantitative in situ hybridization of rare mRNAs using 14C-standards and phosphorus imaging.
2009 Dec 15
Inorganic arsenic modulates the expression of selenoproteins in mouse embryonic stem cell.
2009 Jun 1
Disruption of the arsenic (+3 oxidation state) methyltransferase gene in the mouse alters the phenotype for methylation of arsenic and affects distribution and retention of orally administered arsenate.
2009 Oct
Glutathione-supported arsenate reduction coupled to arsenolysis catalyzed by ornithine carbamoyl transferase.
2009 Sep 1
Monomethylarsenic diglutathione transport by the human multidrug resistance protein 1 (MRP1/ABCC1).
2011 Dec
Role of autophagy in arsenite-induced neurotoxicity: the involvement of α-synuclein.
2015 Mar 18
Patents
Substance Class Chemical
Created
by admin
on Sat Jun 26 15:08:14 UTC 2021
Edited
by admin
on Sat Jun 26 15:08:14 UTC 2021
Record UNII
8C15XFK30P
Record Status Validated (UNII)
Record Version
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Name Type Language
QUININE ARSENATE
WHO-DD  
Common Name English
QUININE ARSENATE [WHO-DD]
Common Name English
CINCHONAN-9-OL, 6'-METHOXY-, (8.ALPHA.,9R)-, ARSENATE (3:2) (SALT)
Common Name English
CHININUM ARSENICICUM [HPUS]
Common Name English
CHININUM ARSENICICUM
HPUS  
Common Name English
Classification Tree Code System Code
CFR 21 CFR 310.547
Created by admin on Sat Jun 26 15:08:14 UTC 2021 , Edited by admin on Sat Jun 26 15:08:14 UTC 2021
NCI_THESAURUS C271
Created by admin on Sat Jun 26 15:08:14 UTC 2021 , Edited by admin on Sat Jun 26 15:08:14 UTC 2021
Code System Code Type Description
ECHA (EC/EINECS)
208-971-4
Created by admin on Sat Jun 26 15:08:14 UTC 2021 , Edited by admin on Sat Jun 26 15:08:14 UTC 2021
PRIMARY
NCI_THESAURUS
C90738
Created by admin on Sat Jun 26 15:08:14 UTC 2021 , Edited by admin on Sat Jun 26 15:08:14 UTC 2021
PRIMARY
PUBCHEM
73415795
Created by admin on Sat Jun 26 15:08:14 UTC 2021 , Edited by admin on Sat Jun 26 15:08:14 UTC 2021
PRIMARY
CAS
549-59-7
Created by admin on Sat Jun 26 15:08:14 UTC 2021 , Edited by admin on Sat Jun 26 15:08:14 UTC 2021
PRIMARY
FDA UNII
8C15XFK30P
Created by admin on Sat Jun 26 15:08:14 UTC 2021 , Edited by admin on Sat Jun 26 15:08:14 UTC 2021
PRIMARY
RXCUI
1309255
Created by admin on Sat Jun 26 15:08:14 UTC 2021 , Edited by admin on Sat Jun 26 15:08:14 UTC 2021
PRIMARY RxNorm
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY