I5784

Ibandronate sodium monohydrate

≥97% (NMR), solid

• Sinónimos: (1-Hydroxy-3-(methylpentylamino)propylidene)bisphosphonic acid sodium monohydrate, Bondronat
• Fórmula empírica (notación de Hill): C₉H₂₂NNaO₇P₂
• Número de CAS: 138844-81-2
• Peso molecular: 341.21
• Número MDL: MFCD07197214
• Código UNSPSC: 41106300
• ID de la sustancia en PubChem: 329815388
• NACRES: NA.77

Propiedades

• Ensayo: ≥97% (NMR)
• Formulario: solid
• condiciones de almacenamiento: protect from light
• color: white
• solubilidad: H₂O: >10 mg/mL
• emisor: Roche
• temp. de almacenamiento: 2-8°C
• cadena SMILES: [Na+].CCCCCN(C)CCC(O)(P(O)(O)=O)P(O)([O-])=O
• InChI: 1S/C9H23NO7P2.Na/c1-3-4-5-7-10(2)8-6-9(11,18(12,13)14)19(15,16)17;/h11H,3-8H2,1-2H3,(H2,12,13,14)(H2,15,16,17);/q;+1/p-1
• Clave InChI: LXLBEOAZMZAZND-UHFFFAOYSA-M
• Información sobre el gen: human ... FDPS(2224)

Descripción

Aplicación

Ibandronate sodium salt has been used to study its effect on the proliferation and ultrastructure of Leishmania and Giardia by the generation of concentration curves.[1] It has also been used to elucidate the route by which nitrogen-containing bisphosphonates (N-BPs) enter the cytosol and inhibit their molecular target.[2]

Acciones bioquímicas o fisiológicas

Ibandronate is a nitrogen-containing bisphosphonate (N-BP).[1] It potentially inhibits mevalonate pathway in osteoclasts. Thus, ibandronate is effectively used to treat osteoporosis and other bone-related diseases.[2]

Ibandronate sodium inhibits farnesyl diphosphate synthase (IC₅₀ = 20 nM). Ibandronate sodium is also a bone resorption inhibitor. It has been investigated for in vitro anti-tumor effects, such as apoptosis induction, inhibitor of cell growth, inhibition of invasive behavior, and inhibition of angiogenesis and for its in vivo role in various cancers including breast and prostate cancers.

Ibandronate sodium is a farnesyl diphosphate synthase inhibitor (IC₅₀ = 20 nM); also a bone resorption inhibitor.

Características y beneficios

This compound was developed by Roche. To browse the list of other pharma-developed compounds and Approved Drugs/Drug Candidates, click here.

Información de seguridad

• Código de clase de almacenamiento: 11 - Combustible Solids
• Clase de riesgo para el agua (WGK): WGK 3
• Punto de inflamabilidad (°F): Not applicable
• Punto de inflamabilidad (°C): Not applicable