Eflornithine hydrochloride hydrate - 10mM in Water , Ornithine decarboxylase inhibitor, CAS No.96020-91-6, Ornithine decarboxylase inhibitor

CAS: 96020-91-6 Cat. No.: E427156 Summenformel: C₆H₁₂F₂N₂O₂·HCl·H₂O Molekulargewicht: 236.65 EG-Nummer: 619-187-0

GRADE & PURITY 10mM in Water

Synonyms

Eflornithine hydrochloride monohydrate | Florexa | (4-METHYLSULFANYL-PHENYL)-PHOSPHONICACIDDIETHYLESTER | A845532 | EFLORNITHINE HYDROCHLORIDE [WHO-DD] | NCGC00093850-01 | Tox21_111224 | 2-(Difluoromethyl)-DL-ornithine hydrochloride | DL-Ornithine, 2-(dif

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Übersicht

Eflornithine(Difluoromethylornithine) inhibits polyamine biosynthesis by the selective, irreversible inhibition of ornithine decarboxylase (ODC). A chemoprotective agent that blocks angiogenesis. Its biological half-life is 8 hours.

A cell-permeable, anticancer agent that acts as a specific and irreversible inhibitor of ornithine decarboxylase (ODC), the rate-limiting enzyme in polyamine biosynthesis. Inhibits B16 melanoma-induced angiogenesis in ovo and proliferation of vascular endothelial cells in vitro.

Specifications

Synonyme

Eflornithine hydrochloride monohydrate | Florexa | (4-METHYLSULFANYL-PHENYL)-PHOSPHONICACIDDIETHYLESTER | A845532 | EFLORNITHINE HYDROCHLORIDE [WHO-DD] | NCGC00093850-01 | Tox21_111224 | 2-(Difluoromethyl)-DL-ornithine hydrochloride | DL-Ornithine, 2-(dif

Spezifikationen & Reinheit

10mM in Water

Storage

Store at -80°C

Verschickt in

Dry ice packs + Cold packs

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Aktionsart

INHIBITOR

Mechanismus der Wirkung

Ornithine decarboxylase inhibitor

Namen und Kennungen

• Pubchem Sid: 528769993
• Kanonisches Lächeln: C(CC(C(F)F)(C(=O)O)N)CN.O.Cl
• IUPAC Name: 2,5-diamino-2-(difluoromethyl)pentanoic acid;hydrate;hydrochloride
• InChIKey: FJPAMFNRCFEGSD-UHFFFAOYSA-N
• INCHI: 1S/C6H12F2N2O2.ClH.H2O/c7-4(8)6(10,5(11)12)2-1-3-9;;/h4H,1-3,9-10H2,(H,11,12);1H;1H2
• Isomere SMILES: C(CC(C(F)F)(C(=O)O)N)CN.O.Cl
• RTECS: RM2981900
• Alternative CAS-Nummer: 70052-12-9
• Molekulargewicht: 236.65
• Reaxy-Rn: 13338246
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13338246&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Ebene5 Amino acids and derivatives
          • Ebene6 Alpha amino acids and derivatives
            • Ebene7 Alpha amino acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acids
• Alternative Parents: Halogenated fatty acids Branched fatty acids Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organofluorides Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid - Branched fatty acid - Halogenated fatty acid - Fatty acid - Fatty acyl - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Alkyl fluoride - Hydrochloride - Primary amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Amine - Organic nitrogen compound - Alkyl halide - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
• External Descriptors: Not available

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

Zugehörige Ziele (nicht menschlich)

Pseudomonas aeruginosa (123386 Activities)

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Klebsiella pneumoniae (43867 Activities)

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Staphylococcus aureus (210822 Activities)

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Acinetobacter baumannii (41033 Activities)

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Escherichia coli (133304 Activities)

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Cryptococcus neoformans (21258 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: heat sensitive
• Schmelzpunkt (°C): 183°C(lit.)
• Molekulargewicht: 236.640 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 236.074 Da
• Monoisotopic Mass: 236.074 Da
• Topological Polar Surface Area: 90.300 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 166.000
• 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: 3

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