Carcinine dihydrochloride - ≥98%(HPLC) , CAS No.57022-38-5

CAS: 57022-38-5 Cat. No.: C171031 Molecular Weight: 255.14 EC Number: 804-247-2 PubChem CID: 6419997

GRADE & PURITY ≥98%(HPLC)

Synonyms

57022-38-5|Decarboxy carnosine hydrochloride|Carcinine dihydrochloride|Carcinine (2HCl)|Alistin|Decarboxy carnosine HCl|beta-Alanylhistamine dihydrochloride|N-(2-(1H-Imidazol-5-yl)ethyl)-3-aminopropanamide dihydrochloride|6X7K9I5QR7|3-amino-N-[2-(1H-imida

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Application：

Carcinine, a natural peptide derivative, with a β-alanyl residue and a histamine, carries an imidazole ring. In mammals, carcinine is present in the brain, muscle, intestine and liver tissues.Carcinine dihydrochloride has been used to study its effects on dopaminergic neuron degeneration.

Specifications

Synonyms

57022-38-5 | Decarboxy carnosine hydrochloride | Carcinine dihydrochloride | Carcinine (2HCl) | Alistin | Decarboxy carnosine HCl | beta-Alanylhistamine dihydrochloride | N-(2-(1H-Imidazol-5-yl)ethyl)-3-aminopropanamide dihydrochloride | 6X7K9I5QR7 | 3-amino-N-[2-(1H-imida

Specifications & Purity

≥98%(HPLC)

Biochemical and Physiological Mechanisms

Carcinine (β-alanyl histamine) is a selective histamine H3 antagonist, 100-1000-fold selective for H3 over H2 and H1, that also functions as an antioxidant and as a chemical chaperone to reduce non-enzymatic glycation of proteins and maintain native foldi

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Action Type

ANTAGONIST

Purity

≥98%(HPLC)

Names and Identifiers

• Pubchem Sid: 504764121
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764121
• Canonical Smiles: C1=C(NC=N1)CCNC(=O)CCN.Cl.Cl
• IUPAC Name: 3-amino-N-[2-(1H-imidazol-5-yl)ethyl]propanamide;dihydrochloride
• InChIKey: ZQTUNIWBUQUKAM-UHFFFAOYSA-N
• INCHI: 1S/C8H14N4O.2ClH/c9-3-1-8(13)11-4-2-7-5-10-6-12-7;;/h5-6H,1-4,9H2,(H,10,12)(H,11,13);2*1H
• Isomeric SMILES: C1=C(NC=N1)CCNC(=O)CCN.Cl.Cl
• WGK Germany: 3
• PubChem CID: 6419997
• Molecular Weight: 255.14

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Beta amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Beta amino acids and derivatives
• Alternative Parents: Imidazoles Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Beta amino acid or derivatives - Azole - Imidazole - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Hydrochloride - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
• 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

Associated Targets(Human)

EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)

Discover Target: EHMT2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

LMNA Tbio Prelamin-A/C (36751 Activities)

Discover Target: LMNA

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Dissolved in water
• Molecular Weight: 255.140 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 254.07 Da
• Monoisotopic Mass: 254.07 Da
• Topological Polar Surface Area: 83.800 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 162.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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: 3

XLogP3