Sodium phosphonoformate hexahydrate - Moligand™, ≥98% , CAS No.34156-56-4

CAS: 34156-56-4 Cat. No.: P133387 Molecular Weight: 300.04 EC Number: 627-459-5 PubChem CID: 169569

GRADE & PURITY Moligand™, ≥98%

Synonyms

Phosphonoformic acid, trisodium salt, hexahydrate | Phosphonoformic acid trisodium salt hexahydrate | FOSCARNET SODIUM [USP MONOGRAPH] | Prestwick_1024 | Z1618161020 | D82048 | FOSCARNET SODIUM HEXAHYDRATE [VANDF] | Foscarnet sodium hydrate (JAN) | Trisod

Storage

Room temperature,Argon charged

Shipped In

Normal

Overview

An antiviral agent and reverse transcriptase inhibitor

Foscarnet trisodium hexahydrate (Trisodium phosphonatoformate hexahydrate) is a viral DNA polymerase activity inhibitor, leading to reversible suppression of viral replication. Foscarnet trisodium hexahydrate is an antiherpesvirus agent used in cytomegalovirus retinitis

Specifications

Synonyms

Phosphonoformic acid, trisodium salt, hexahydrate | Phosphonoformic acid trisodium salt hexahydrate | FOSCARNET SODIUM [USP MONOGRAPH] | Prestwick_1024 | Z1618161020 | D82048 | FOSCARNET SODIUM HEXAHYDRATE [VANDF] | Foscarnet sodium hydrate (JAN) | Trisod

Specifications & Purity

Moligand™, ≥98%

Storage

Room temperature, Argon charged

Shipped In

Normal

Grade

Moligand™

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488188429
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488188429
• Canonical Smiles: C(=O)([O-])P(=O)([O-])[O-].O.O.O.O.O.O.[Na+].[Na+].[Na+]
• IUPAC Name: trisodium;phosphonatoformate;hexahydrate
• InChIKey: ILRVASBWNRYBFD-UHFFFAOYSA-K
• INCHI: 1S/CH3O5P.3Na.6H2O/c2-1(3)7(4,5)6;;;;;;;;;/h(H,2,3)(H2,4,5,6);;;;6*1H2/q;3*+1;;;;;;/p-3
• Isomeric SMILES: C(=O)([O-])P(=O)([O-])[O-].O.O.O.O.O.O.[Na+].[Na+].[Na+]
• Alternate CAS: 63585-09-1
• PubChem CID: 169569
• Molecular Weight: 300.04

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Organic phosphonic acids and derivatives
      • Subclass Organic phosphonic acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Organic phosphonic acids and derivatives
• Subclass: Organic phosphonic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic phosphonic acids
• Alternative Parents: Organic carbonic acids and derivatives Organopnictogen compounds Organophosphorus compounds Organooxygen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organophosphonic acid - Carbonic acid derivative - Organic alkali metal salt - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organophosphorus compound - Organooxygen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organic phosphonic acids. These are organic compounds containing phosphonic acid.
• External Descriptors: hydrate - one-carbon compound

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

Human alphaherpesvirus 1 (11089 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Moisture sensitive
• Refractive Index: 1.53
• Melt Point(°C): >300°C
• Molecular Weight: 300.040 g/mol
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 0
• Exact Mass: 299.981 Da
• Monoisotopic Mass: 299.981 Da
• Topological Polar Surface Area: 109.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 103.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 10

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