Alendronate sodium trihydrate - 10mM in Water , CAS No.121268-17-5

CAS: 121268-17-5 Cat. No.: A420924 Formula: C₄H₁₂NaNO₇P₂·3H₂O Peso molecolare: 325.12 Numero EC: 601-766-4

GRADE & PURITY 10mM in Water

Synonyms

121268-17-5|Alendronate sodium trihydrate|Fosamax|Alendronate monosodium trihydrate|Alendronate sodium hydrate|Adronat|Alendros|Sodium alendronate|SODIUM ALENDRONATE TRIHYDRATE|2UY4M2U3RA|CHEBI:2566|Alendronic acid monosodium salt trihydrate|DTXSID7047801

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Panoramica

It's odorless and tasteless.Alendronate sodium trihydrate is a bone resorption inhibitor, farnesyl diphosphate synthase inhibitor and CD45 protein tyrosine phosphatase inhibitor.

Specifications

Sinonimi

121268-17-5 | Alendronate sodium trihydrate | Fosamax | Alendronate monosodium trihydrate | Alendronate sodium hydrate | Adronat | Alendros | Sodium alendronate | SODIUM ALENDRONATE TRIHYDRATE | 2UY4M2U3RA | CHEBI:2566 | Alendronic acid monosodium salt trihydrate | DTXSID7047801

Specifiche e purezza

10mM in Water

Meccanismi biochimici e fisiologici

Alendronate sodium trihydrate is a bone resorption inhibitor; farnesyl diphosphate synthase inhibitor (IC50 = 460 nM); CD45 protein tyrosine phosphatase inhibitor.Potent bone resorption inhibitor. Inhibits farnesyl synthase (IC 50 = 460 nM) and the isopre

Condizioni di conservazione di stoccaggio

Store at -80°C

Spedito in

Dry ice packs + Cold packs

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Nomi e identificatori

Pubchem Sid

528776276

Sorrisi canonici

C(CC(O)(P(=O)(O)O)P(=O)(O)[O-])CN.O.O.O.[Na+]

IUPAC Name

sodium;(4-amino-1-hydroxy-1-phosphonobutyl)-hydroxyphosphinate;trihydrate

InChIKey

DCSBSVSZJRSITC-UHFFFAOYSA-M

INCHI

1S/C4H13NO7P2.Na.3H2O/c5-3-1-2-4(6,13(7,8)9)14(10,11)12;;;;/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12);;3*1H2/q;+1;;;/p-1

Isomeri SMILES

C(CC(O)(P(=O)(O)O)P(=O)(O)[O-])CN.O.O.O.[Na+]

WGK Germania

3

RTECS

SZ6523500

Peso molecolare

325.12

Reaxy-Rn

13434693

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13434693&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Organic phosphonic acids and derivatives
      • Subclass Bisphosphonates

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Organic phosphonic acids and derivatives
• Subclass: Bisphosphonates
• Intermediate Tree Nodes: Not available
• Direct Parent: Bisphosphonates
• Alternative Parents: Organic phosphonic acids Organopnictogen compounds Organophosphorus compounds Organooxygen compounds Organic zwitterions Organic sodium salts Organic oxides Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Bisphosphonate - Organophosphonic acid - Organic alkali metal salt - Amine - Organic oxide - Hydrocarbon derivative - Organopnictogen compound - Organic sodium salt - Organic salt - Organic zwitterion - Primary amine - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Primary aliphatic amine - Organic nitrogen compound - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as bisphosphonates. These are organic compounds containing two phosphonate groups linked together through a carbon atoms.
• External Descriptors: hydrate - organic sodium salt

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

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: heat sensitive
• Peso molecolare: 325.120 g/mol
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 5
• Exact Mass: 325.03 Da
• Monoisotopic Mass: 325.03 Da
• Topological Polar Surface Area: 167.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 293.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 5

XLogP3