DCIA , CAS No.76877-34-4

CAS: 76877-34-4 Cat. No.: D1454622 Molecular Weight: 490.334 EC Number: 634-753-7 PubChem CID: 127530

Storage

Protected from light,Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Overview

DCIA is a fluorescent dye. DCIA contains a coumarin fluorophore and conjugates specifically with free cysteines in the protein.

Specifications

Storage

Protected from light, Store at -20°C, Desiccated

Shipped In

Ice chest + Ice pads

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

Names and Identifiers

• Canonical Smiles: CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C3=CC=C(C=C3)NC(=O)CI)C
• IUPAC Name: N-[4-[7-(diethylamino)-4-methyl-2-oxochromen-3-yl]phenyl]-2-iodoacetamide
• InChIKey: WIXAQXKQLNRFDF-UHFFFAOYSA-N
• INCHI: 1S/C22H23IN2O3/c1-4-25(5-2)17-10-11-18-14(3)21(22(27)28-19(18)12-17)15-6-8-16(9-7-15)24-20(26)13-23/h6-12H,4-5,13H2,1-3H3,(H,24,26)
• Isomeric SMILES: CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C3=CC=C(C=C3)NC(=O)CI)C
• WGK Germany: 3
• PubChem CID: 127530
• Molecular Weight: 490.334

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • Class Isoflavonoids
      • Subclass Isoflav-3-enes

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Class: Isoflavonoids
• Subclass: Isoflav-3-enes
• Intermediate Tree Nodes: Not available
• Direct Parent: Isoflav-3-enones
• Alternative Parents: Coumarins and derivatives 1-benzopyrans Anilides N-arylamides Dialkylarylamines Pyranones and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Lactones Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organoiodides Alkyl iodides Organopnictogen compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Isoflav-3-enone skeleton - Coumarin - Benzopyran - 1-benzopyran - Anilide - Dialkylarylamine - Tertiary aliphatic/aromatic amine - N-arylamide - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Lactone - Secondary carboxylic acid amide - Tertiary amine - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Organohalogen compound - Amine - Organic oxide - Organopnictogen compound - Organoiodide - Alkyl iodide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Alkyl halide - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as isoflav-3-enones. These are flavonoids with a structure based on an isoflav-3-ene skeleton bearing an oxo-group at position C2.
• 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