Bestatina estere metilico - ≥97% , CAS No.65322-89-6

CAS: 65322-89-6 Cat. No.: B275720 Formula: C₁₇H₂₆N₂O₄ Peso molecolare: 322.4

QUALITÀ & PUREZZA ≥97%

Synonyms

Bestatina estere metilico | BDBM50251279 | (S)-metile 2-((2S,3R)-3-amino-2-idrossi-4-fenilbutanamido)-4-metilpentanoato | Bestatina metilica | DTXSID20432965 | SCHEMBL9574604 | AT39119 | metile (2S)-2-[(2S,3R)-3-amino-2-idrossi-4-fenilbutanoil]amino]-4-me

Storage

Conservare a 2-8°C

Shipped In

Ghiaccio umido

Panoramica

Conservare a +4°C. Il prodotto può essere conservato fino a 12 mesi.

Specifiche

Sinonimi

Bestatina estere metilico | BDBM50251279 | (S)-metile 2-((2S,3R)-3-amino-2-idrossi-4-fenilbutanamido)-4-metilpentanoato | Bestatina metilica | DTXSID20432965 | SCHEMBL9574604 | AT39119 | metile (2S)-2-[(2S,3R)-3-amino-2-idrossi-4-fenilbutanoil]amino]-4-me

Specifiche e purezza

≥97%

Meccanismi biochimici e fisiologici

Derivato permeabile alle cellule della Bestatina. Mostra un'inibizione leggermente più forte dell'aminopeptidasi neutra rispetto alla Bestatina, ma ha un'attività molto più debole nei confronti dell'aminopeptidasi basica.

Condizioni di conservazione di stoccaggio

Conservare a 2-8°C

Spedito in

Ghiaccio umido

Tipo di azione

INHIBITOR

Nota

Per quanto possibile, si consiglia di preparare e utilizzare le soluzioni lo stesso giorno. Tuttavia, se è necessario preparare in anticipo le soluzioni di riserva, si consiglia di conservarle in aliquote in fiale ben chiuse a -20°C. In genere, queste possono essere utilizzate per un mese. In genere, queste soluzioni sono utilizzabili fino a un mese. Prima dell'uso e dell'apertura della fiala, si consiglia di lasciare che il prodotto si equilibri a temperatura ambiente per almeno 1 ora. Avete bisogno di ulteriori consigli su solubilità, uso e manipolazione? Per ulteriori informazioni, visitare la pagina delle domande frequenti (FAQ).

Purezza

≥97%

Nomi e identificatori

Sorrisi canonici

CC(C)CC(C(=O)OC)NC(=O)C(C(CC1=CC=CC=C1)N)O

IUPAC Name

methyl (2S)-2-[[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoate

InChIKey

WGNKTWBIPBOGLO-ILXRZTDVSA-N

INCHI

1S/C17H26N2O4/c1-11(2)9-14(17(22)23-3)19-16(21)15(20)13(18)10-12-7-5-4-6-8-12/h4-8,11,13-15,20H,9-10,18H2,1-3H3,(H,19,21)/t13-,14+,15+/m1/s1

Isomeri SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)[C@H]([C@@H](CC1=CC=CC=C1)N)O

Peso molecolare

322.4

Reaxy-Rn

48731900

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=48731900&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Peptidomimetics
      • Subclass Hybrid peptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Peptidomimetics
• Subclass: Hybrid peptides
• Intermediate Tree Nodes: Not available
• Direct Parent: Hybrid peptides
• Alternative Parents: Leucine and derivatives Alpha amino acid esters N-acyl-alpha amino acids and derivatives Beta amino acids and derivatives Amphetamines and derivatives Aralkylamines Fatty acid esters N-acyl amines Monosaccharides Methyl esters Secondary carboxylic acid amides Secondary alcohols Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organopnictogen compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Hybrid peptide - Leucine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Beta amino acid or derivatives - Alpha-amino acid or derivatives - Amphetamine or derivatives - Fatty acid ester - Aralkylamine - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Monosaccharide - N-acyl-amine - Benzenoid - Methyl ester - Amino acid or derivatives - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Alcohol - Organonitrogen compound - Organooxygen compound - Primary amine - Primary aliphatic amine - Amine - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as hybrid peptides. These are compounds containing at least two different types of amino acids (alpha, beta, gamma, delta) linked to each other through a peptide bond.
• 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

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in DMSO
• Peso molecolare: 322.400 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 322.189 Da
• Monoisotopic Mass: 322.189 Da
• Topological Polar Surface Area: 102.000 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 381.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 3
• 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: 1