Maléate d'énalapril - ≥98% , Angiotensin-converting enzyme inhibitor, CAS No.76095-16-4, Angiotensin-converting enzyme inhibitor

CAS: 76095-16-4 Cat. No.: E129304 Formule: C₂₀H₂₈N₂O₅·C₄H₄O₄ Poids moléculaire: 492.52 Numéro CE: 278-375-7 PubChem CID: 5388961

GRADE & PURITY ≥98%

Synonyms

Enaloc | Renitec | (S)-1-(N-(1-(1-(Ethoxycarbonyl)-3-phenylpropyl)-L-alanyl)-L-proline maleate | Defluin | MLS000028657 | Prilenap | Renitec Maleate | Innovade | MFCD00133304 | (S)-1-[N-[1-(ETHOXYCARBONYL)-3-PHENYLPROPYL]-L-ALANYL]-L-PROLINE MALEATE | Ate

Storage

Room temperature

Shipped In

Normal

Vue d’ensemble

Le maléate d'énalapril, métabolite actif de l'énalapril, entre en compétition avec l'angiotensine I pour se lier à l'enzyme de conversion de l'angiotensine, bloquant ainsi la conversion de l'angiotensine I en angiotensine II.
Inhibiteur de l'enzyme de conversion de l'angiotensine.

Specifications

Synonymes

Enaloc | Renitec | (S)-1-(N-(1-(1-(Ethoxycarbonyl)-3-phenylpropyl)-L-alanyl)-L-proline maleate | Defluin | MLS000028657 | Prilenap | Renitec Maleate | Innovade | MFCD00133304 | (S)-1-[N-[1-(ETHOXYCARBONYL)-3-PHENYLPROPYL]-L-ALANYL]-L-PROLINE MALEATE | Ate

Spécifications et pureté

≥98%

Mécanismes biochimiques et physiologiques

Le maléate d'énalapril est un inhibiteur efficace et puissant de l'enzyme de conversion de l'angiotenson (ECA) sans sulfhydryle. Ce composé a été utilisé pour étudier l'angiopathie diabétique chez les rats diabétiques et l'inhibition de l'ECA dans le plas

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Type d'action

INHIBITOR

Mécanisme d'action

Angiotensin-converting enzyme inhibitor

Note

Dans la mesure du possible, les solutions doivent être préparées et utilisées le même jour. Toutefois, si vous devez préparer des solutions de base à l'avance, nous vous recommandons de les conserver sous forme d'aliquotes dans des flacons hermétiques à -20°C. Ces aliquotes sont généralement utilisables pendant un mois. En général, ces solutions peuvent être utilisées pendant un mois. Avant utilisation, et avant d'ouvrir le flacon, nous vous recommandons de laisser votre produit s'équilibrer à température ambiante pendant au moins 1 heure. Besoin de plus de conseils sur la solubilité, l'utilisation et la manipulation ? Veuillez consulter notre page de questions fréquemment posées (FAQ) pour plus de détails.

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 504763816
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504763816
• Sourires canoniques: CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCC2C(=O)O.C(=CC(=O)O)C(=O)O
• IUPAC Name: (Z)-but-2-enedioic acid;(2S)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid
• InChIKey: OYFJQPXVCSSHAI-QFPUQLAESA-N
• INCHI: 1S/C20H28N2O5.C4H4O4/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25;5-3(6)1-2-4(7)8/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25);1-2H,(H,5,6)(H,7,8)/b;2-1-/t14-,16-,17-;/m0./s1
• Isomères SMILES: CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)O.C(=C\C(=O)O)\C(=O)O
• WGK Allemagne: 2
• RTECS: TW3666000
• CAS alternatif: 75847-73-3
• PubChem CID: 5388961
• Poids moléculaire: 492.52

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Peptides
          • Level6 Dipeptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Dipeptides
• Alternative Parents: Alpha amino acid esters Proline and derivatives N-acyl-L-alpha-amino acids Alpha amino acid amides Pyrrolidine carboxylic acids N-acylpyrrolidines Aralkylamines Fatty acid esters Unsaturated fatty acids Benzene and substituted derivatives Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Carboxylic acid esters Amino acids Dialkylamines Carboxylic acids Azacyclic compounds Carbonyl compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Alpha-dipeptide - N-acyl-alpha-amino acid - N-acyl-l-alpha-amino acid - Proline or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - Alpha-amino acid amide - Alpha-amino acid or derivatives - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Aralkylamine - Fatty acid ester - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty acyl - Fatty acid - Unsaturated fatty acid - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Carboxylic acid ester - Carboxamide group - Amino acid or derivatives - Amino acid - Azacycle - Organoheterocyclic compound - Carboxylic acid - Secondary aliphatic amine - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organopnictogen compound - Amine - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
• External Descriptors: maleate 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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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Soluble in water (25 mg/ml), methanol (50 mg/ml), and ethanol (8 mg/ml).
• Rotation spécifique [α]: [α]D： -41° (C=1,MeOH)
• Point de fusion (°C): 143-145°
• Poids moléculaire: 492.500 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 12
• Exact Mass: 492.211 Da
• Monoisotopic Mass: 492.211 Da
• Topological Polar Surface Area: 171.000 Ų
• Heavy Atom Count: 35
• Formal Charge: 0
• Complexity: 637.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 3
• 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