Coumarin 314

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Coumarin 314

Coumarin 314 | CAS 55804-66-5

Catalog Number A17-0002
Category Coumarin
Molecular Formula C18H19NO4
Molecular Weight 313.35
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Product Introduction

Coumarin 314 is a compound with a fluorescent group. It has powerful anti-inflammatory, analgesic and anti-cancer abilities, and plays an important role in suppressing pain, diluting coagulation factors in the blood, and fighting malignant tumors. It greatly hinders the targeted enzymes and mechanisms involved in the above-mentioned diseases.

  • Chemical Information

  • Product Specification

  • Application

  • Computed Properties

  • Patents

Synonyms 2,3,6,7-tetrahydro-11-oxo-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizine-10-carboxylic acid, ethyl ester; Coumarin 504; 2,3,5,6-1H,4H-Tetrahydro-9-carbethoxyquinolizino-[9,9a,1-gh]coumarin
IUPAC Name ethyl 4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraene-5-carboxylate
Canonical SMILES CCOC(=O)C1=CC2=CC3=C4C(=C2OC1=O)CCCN4CCC3
InChI InChI=1S/C18H19NO4/c1-2-22-17(20)14-10-12-9-11-5-3-7-19-8-4-6-13(15(11)19)16(12)23-18(14)21/h9-10H,2-8H2,1H3
InChIKey VMJKUPWQKZFFCX-UHFFFAOYSA-N
Storage 24 months after receival at -20°C in the dark. Transportation: at room temperature for up to 3 weeks. Avoid prolonged exposure to light.
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 313.13140809 g/mol
Monoisotopic Mass 313.13140809 g/mol
Topological Polar Surface Area 55.8Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 543
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
Publication Number Title Priority Date
EP-4105035-A1 Label and system for verifying the authenticity of items and method for verifying authenticity of items 2021-06-15
WO-2022263301-A1 Label and system for verifying the authenticity of items and method for verifying authenticity of items 2021-06-15
CN-113270786-B Solid-state dye laser gain medium and preparation method thereof 2021-05-12
US-2022315614-A1 Reducing agents and uses thereof 2021-03-19
US-2022153932-A1 Prepolymers of 1,1-dicarbonyl substituted-1-alkene, methods to make them, polymers made from them and methods to make the polymer 2020-11-18

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