L-Arginyl-L-arginine 7-amido-4- methylcoumarin trihydrochloride - ≥98% , CAS No.201847-69-0

CAS: 201847-69-0 Cat. No.: L331384 Molecular Weight: 596.94 PubChem CID: 24801918

GRADE & PURITY ≥98%

Synonyms

H-Arg-Arg-AMC . 3 HCI | (2S)-2-amino-5-(diaminomethylideneamino)-N-[(2S)-5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]pentanamide;trihydrochloride | DTXSID90647367 | L-Arginyl-L-arginine 7-amido-4- methylcoumarin trih

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

L-Arginyl-L-arginine 7-amido-4- methylcoumarin trihydrochloride is a fluorogenic substrate for cathepsin B or aminopeptidase III. It yields a blue fluorescent solution upon cleavage.

Specifications

Synonyms

H-Arg-Arg-AMC . 3 HCI | (2S)-2-amino-5-(diaminomethylideneamino)-N-[(2S)-5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]pentanamide;trihydrochloride | DTXSID90647367 | L-Arginyl-L-arginine 7-amido-4- methylcoumarin trih

Specifications & Purity

≥98%

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.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCCN=C(N)N)NC(=O)C(CCCN=C(N)N)N.Cl.Cl.Cl
• IUPAC Name: (2S)-2-amino-5-(diaminomethylideneamino)-N-[(2S)-5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]pentanamide;trihydrochloride
• InChIKey: FFHVRMNAOAAXTM-XYTXGRHFSA-N
• INCHI: 1S/C22H33N9O4.3ClH/c1-12-10-18(32)35-17-11-13(6-7-14(12)17)30-20(34)16(5-3-9-29-22(26)27)31-19(33)15(23)4-2-8-28-21(24)25;;;/h6-7,10-11,15-16H,2-5,8-9,23H2,1H3,(H,30,34)(H,31,33)(H4,24,25,28)(H4,26,27,29);3*1H/t15-,16-;;;/m0.../s1
• Isomeric SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)N.Cl.Cl.Cl
• PubChem CID: 24801918
• Molecular Weight: 596.94

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Dipeptides
• Alternative Parents: N-acyl-alpha amino acids and derivatives Alpha amino acid amides Coumarins and derivatives 1-benzopyrans N-arylamides Pyranones and derivatives Benzenoids N-acyl amines Heteroaromatic compounds Secondary carboxylic acid amides Guanidines Lactones Propargyl-type 1,3-dipolar organic compounds Carboximidamides Oxacyclic compounds Monoalkylamines Organic oxides Carbonyl compounds Hydrocarbon derivatives Hydrochlorides
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Coumarin - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzopyran - 1-benzopyran - N-arylamide - Pyranone - Fatty amide - Benzenoid - Fatty acyl - N-acyl-amine - Pyran - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Guanidine - Lactone - Secondary carboxylic acid amide - Organoheterocyclic compound - Oxacycle - Carboximidamide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic oxide - Amine - Primary aliphatic amine - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Primary amine - Organic nitrogen compound - Hydrochloride - Aromatic heteropolycyclic 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: 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

Chemical and Physical Properties

• Sensitivity: Moisture sensitive.
• Molecular Weight: 596.900 g/mol
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 12
• Exact Mass: 595.196 Da
• Monoisotopic Mass: 595.196 Da
• Topological Polar Surface Area: 239.000 Ų
• Heavy Atom Count: 38
• Formal Charge: 0
• Complexity: 850.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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: 4

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