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Details

Stereochemistry ABSOLUTE
Molecular Formula 3C20H24N2O2.2AsH3O4
Molecular Weight 1257.1363
Optical Activity UNSPECIFIED
Defined Stereocenters 12 / 12
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Quinine arsenate

SMILES

O[As](O)(O)=O.O[As](O)(O)=O.[H][C@]1(C[C@@H]2CCN1C[C@@H]2C=C)[C@H](O)C3=C4C=C(OC)C=CC4=NC=C3.[H][C@]5(C[C@@H]6CCN5C[C@@H]6C=C)[C@H](O)C7=C8C=C(OC)C=CC8=NC=C7.[H][C@]9(C[C@@H]%10CCN9C[C@@H]%10C=C)[C@H](O)C%11=C%12C=C(OC)C=CC%12=NC=C%11

InChI

InChIKey=CDTYBBCOIQJQRO-INGJVHGESA-N
InChI=1S/3C20H24N2O2.2AsH3O4/c3*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*2-1(3,4)5/h3*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;2*(H3,2,3,4,5)/t3*13-,14-,19-,20+;;/m000../s1

HIDE SMILES / InChI

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 324.4168
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
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
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
Developmentally restricted genetic determinants of human arsenic metabolism: association between urinary methylated arsenic and CYT19 polymorphisms in children.
2005 Jun
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
Arsenite-induced cytotoxicity in dorsal root ganglion explants.
2008 Apr 15
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
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 Wed Jul 05 23:16:45 UTC 2023
Edited
by admin
on Wed Jul 05 23:16:45 UTC 2023
Record UNII
8C15XFK30P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Quinine arsenate
WHO-DD  
Common Name English
Cinchonan-9-ol, 6′-methoxy-, (8α,9R)-, arsenate (3:2) (salt)
Systematic Name English
Quinine arsenate [WHO-DD]
Common Name English
CHININUM ARSENICICUM [HPUS]
Common Name English
CHININUM ARSENICICUM
HPUS  
Common Name English
Arsenic acid (H<sub>3</sub>AsO<sub>4</sub>), compd. with (8α,9R)-6′-methoxycinchonan-9-ol (2:3)
Systematic Name English
Classification Tree Code System Code
CFR 21 CFR 310.547
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
NCI_THESAURUS C271
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
Code System Code Type Description
ECHA (EC/EINECS)
208-971-4
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
PRIMARY
NCI_THESAURUS
C90738
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
PRIMARY
EPA CompTox
DTXSID70970226
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
PRIMARY
DAILYMED
8C15XFK30P
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
PRIMARY
CAS
549-59-7
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
PRIMARY
FDA UNII
8C15XFK30P
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
PRIMARY
PUBCHEM
20841765
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
PRIMARY
RXCUI
1309255
Created by admin on Wed Jul 05 23:16:45 UTC 2023 , Edited by admin on Wed Jul 05 23:16:45 UTC 2023
PRIMARY RxNorm
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY