Pralidoxime Iodide - 10mM in DMSO , CAS No.94-63-3

CAS: 94-63-3 Cat. No.: P427049 Formule: C₇H₉IN₂O Poids moléculaire: 264.06 Numéro CE: 202-349-6

GRADE & PURITY 10mM in DMSO

Synonyms

(6S,7S,E)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid | pralidoxime iodide | BSPBio_001000 | GS 1043 | Pralidossima joduro | 2-[(E)-(hydroxyimino)methyl]-1-methylpyri

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Vue d’ensemble

Information

Pralidoxime Iodide Pralidoxime Iodide (2-PAM) is an antidote approved for reactivation of inhibited acetylcholinesterase (AChE) in organophosphate poisoning.

Specifications

Synonymes

(6S,7S,E)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid | pralidoxime iodide | BSPBio_001000 | GS 1043 | Pralidossima joduro | 2-[(E)-(hydroxyimino)methyl]-1-methylpyri

Spécifications et pureté

10mM in DMSO

Mécanismes biochimiques et physiologiques

Pralidoxime Iodide (2-PAM) is an antidote approved for reactivation of inhibited acetylcholinesterase (AChE) in organophosphate poisoning.

Conditions de stockage de stockage

Store at -80°C

Expédié en

Dry ice packs + Cold packs

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Noms et identifiants

• Pubchem Sid: 528774236
• Sourires canoniques: C[N+]1=CC=CC=C1C=NO.[I-]
• IUPAC Name: (NE)-N-[(1-methylpyridin-1-ium-2-yl)methylidene]hydroxylamine;iodide
• InChIKey: QNBVYCDYFJUNLO-UHFFFAOYSA-N
• INCHI: 1S/C7H8N2O.HI/c1-9-5-3-2-4-7(9)6-8-10;/h2-6H,1H3;1H
• Isomères SMILES: C[N+]1=CC=CC=C1/C=N/O.[I-]
• Poids moléculaire: 264.06

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Hydropyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Hydropyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Dihydropyridines
• Alternative Parents: Trialkylamines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Enamines Azacyclic compounds Aminoxides Allylamines Organopnictogen compounds Organic oxides Organic iodide salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Dihydropyridine - Tertiary amine - Tertiary aliphatic amine - Enamine - Organic oxoazanium - Allylamine - Azacycle - Aminoxide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Amine - Organic salt - Organic iodide salt - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as dihydropyridines. These are compounds containing a dihydropyridine moiety, which is a semi-saturated pyridine derivative with two double bonds.
• External Descriptors: pyridinium salt - organic iodide 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

Propriétés chimiques et physiques

• Point de fusion (°C): ca 225° dec.
• Poids moléculaire: 264.060 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 263.976 Da
• Monoisotopic Mass: 263.976 Da
• Topological Polar Surface Area: 36.500 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 125.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 2

XLogP3

Références

1. Jian Zhang, Yibing Li, Ting Zhang, Zhihong Zheng, Hui Jing, Chunye Liu.  (2023)  Improving pesticide residue detection: Immobilized enzyme microreactor embedded in microfluidic paper-based analytical devices.  FOOD CHEMISTRY,      [PMID:38091789] [10.1016/j.foodchem.2023.138179]

2. Linghao He, Bingbing Cui, Jiameng Liu, Yingpan Song, Minghua Wang, Donglai Peng, Zhihong Zhang.  (2017)  Novel electrochemical biosensor based on core-shell nanostructured composite of hollow carbon spheres and polyaniline for sensitively detecting malathion.  SENSORS AND ACTUATORS B-CHEMICAL,      [PMID:] [10.1016/j.snb.2017.11.161]

3. Jing Dong, Juying Hou, Jianxia Jiang, Shiyun Ai.  (2015)  Innovative approach for the electrochemical detection of non-electroactive organophosphorus pesticides using oxime as electroactive probe.  ANALYTICA CHIMICA ACTA,      [PMID:26231893] [10.1016/j.aca.2015.05.033]