DISODIUM ARSONOACETATE MONOHYDRATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C2H3AsO5.2Na.H2O
Molecular Weight	245.9586
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DISODIUM ARSONOACETATE MONOHYDRATE

Structure Search

SMILES

O.[Na+].[Na+].O[As]([O-])(=O)CC([O-])=O

InChI

InChIKey=RJTDUAJFVQDGBM-UHFFFAOYSA-L

InChI=1S/C2H5AsO5.2Na.H2O/c4-2(5)1-3(6,7)8;;;/h1H2,(H,4,5)(H2,6,7,8);;;1H2/q;2*+1;/p-2

HIDE SMILES / InChI

Molecular Formula	C2H4AsO5
Molecular Weight	182.9718
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	HO
Molecular Weight	17.0073
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: Sullivan, R.J. (1969) 'AIR POLLUTION ASPECTS OF ARSENIC AND ITS COMPOUNDS', p.60 Retrieved from https://yosemite.epa.gov/oa/EAB_Web_Docket.nsf/Attachments%20By%20ParentFilingId/3B14C316D06D4BCE85257F40006A588B//NAPCA%201969.pdfhttps://pubchem.ncbi.nlm.nih.gov/compound/67177
Curator's Comment: description was created based on several sources, including https://dailymed.nlm.nih.gov/dailymed/fda/fdaDrugXsl.cfm?setid=35df5050-2215-4b1d-e054-00144ff8d46c&type=display | http://starlabs.com.pk/mericyl-injection.html

Disodium carboxymethylarsonate (disodium arsonoacetate, MERICYL) is a salt of arsonoacetic acid. It is used as a roborant and general tonic in veterinary practice. Also this compound can be found in some fluoride toothpastes as an inactive ingredient.

CNS Activity

Originator

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Bacterial DNA-directed RNA polymerase 11 Target ID: CHEMBL2364672 Sources: https://www.ncbi.nlm.nih.gov/pubmed/6083781	Modulator 828

Conditions

Condition	Modality	Highest Phase	Product
Babesiosis 7 Sources: Sullivan, R.J. (1969) Air pollution aspects of arsenic and its compounds, p.60, retrieved from: https://books.google.ru/books?id=jbcvAAAAYAAJ	Primary	Not Provided 504	Unknown Approved Use Unknown
Nervous diseases 3 Sources: Sullivan, R.J. (1969) Air pollution aspects of arsenic and its compounds, p.60, retrieved from: https://books.google.ru/books?id=jbcvAAAAYAAJ	Primary	Not Provided 504	Unknown Approved Use Unknown
Eclampsia 69 Sources: Sullivan, R.J. (1969) Air pollution aspects of arsenic and its compounds, p.60, retrieved from: https://books.google.ru/books?id=jbcvAAAAYAAJ	Primary	Not Provided 504	Unknown Approved Use Unknown
Nutritional supplements 3 Sources: http://starlabs.com.pk/mericyl-injection.html	Primary	Not Provided 504	MERICYL Approved Use Roborant and general tonic (nutritional supplements)
Dental cavities 3 Sources: https://dailymed.nlm.nih.gov/dailymed/fda/fdaDrugXsl.cfm?setid=35df5050-2215-4b1d-e054-00144ff8d46c&type=display	Inactive ingredient	Not Provided 504	AMERFRESH Approved Use Aids in the prevention of dental cavities

PubMed

Title	Date	PubMed
Mode of action of phosphonoformate as an anti-herpes simplex virus agent.	1981 Jan 29	6260189
Carbon-arsenic bond cleavage by a newly isolated gram-negative bacterium, strain ASV2.	1995 Mar	7711909
The construction of a whole-cell biosensor for phosphonoacetate, based on the LysR-like transcriptional regulator PhnR from Pseudomonas fluorescens 23F.	2009 Mar	21261917

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Strain ASV2, an unidentified Gram-negative bacterium newly isolated from activated sludge, was found to utilize Arsonoacetic acid at concentrations up to at least 30 mM as sole carbon and energy source, with essentially quantitative extracellular release of arsenate.

Substance Class	Chemical Created by `admin` on `Sat Dec 16 07:48:02 GMT 2023` Edited by `admin` on `Sat Dec 16 07:48:02 GMT 2023`
Record UNII	NI6S09757V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DISODIUM ARSONOACETATE MONOHYDRATE

Systematic Name

English

ARSONOACETIC ACID SODIUM SALT MONOHYDRATE

Common Name

English

ACETIC ACID, 2-ARSONO-, SODIUM SALT, HYDRATE (1:2:1)

Common Name

English

ARICYL

Brand Name

English

ARSONOACETIC ACID SODIUM SALT MONOHYDRATE [MI]

Common Name

English

ARSONOACETIC ACID DISODIUM SALT MONOHYDRATE

Common Name

English

DISODIUM ACETARSENATE MONOHYDRATE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID40208922