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Flexirubin

Base Information Edit
  • Chemical Name:Flexirubin
  • CAS No.:54363-90-5
  • Molecular Formula:C43H54O4
  • Molecular Weight:634.8865
  • Hs Code.:
  • UNII:SEG49MSH93
  • Nikkaji Number:J13.067B,J3.219.421D
  • Wikipedia:Flexirubin
  • Wikidata:Q1428304
  • Metabolomics Workbench ID:94407
  • Mol file:54363-90-5.mol
Flexirubin

Synonyms:flexirubins

Suppliers and Price of Flexirubin
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
Total 12 raw suppliers
Chemical Property of Flexirubin Edit
Chemical Property:
  • Vapor Pressure:2.1E-26mmHg at 25°C 
  • Boiling Point:797.1°Cat760mmHg 
  • Flash Point:235.5°C 
  • PSA:66.76000 
  • Density:1.041g/cm3 
  • LogP:11.69020 
  • XLogP3:14.5
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:22
  • Exact Mass:634.40221020
  • Heavy Atom Count:47
  • Complexity:1060
Purity/Quality:

99% *data from raw suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CCCCCCCCCCCCC1=C(C=C(C=C1OC(=O)C=CC=CC=CC=CC=CC=CC=CC=CC2=CC(=C(C=C2)O)C)C)O
  • Isomeric SMILES:CCCCCCCCCCCCC1=C(C=C(C=C1OC(=O)/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C2=CC(=C(C=C2)O)C)C)O
Refernces Edit

INVESTIGATIONS ON THE BIOSYNTHESIS OF FLEXIRUBIN - THE ORIGIN OF BENZENE RING B AND ITS SUBSTITUENTS

10.1016/S0040-4020(01)97645-8

The research presents an in-depth investigation into the biosynthesis of flexirubin, a pigment produced by the gliding bacterium Flexibacter elegans. The study aimed to trace the origin of the benzene ring B and its substituents in flexirubin, using "C- and "C-labeled acetate and butyrate. The conclusions drawn from the experiments were that all carbon atoms of ring B and its alkyl substituents are derived from acetate, with 3-dodecylorsellinic and orsellinic acid identified as intermediates in the biosynthesis. The research also established that the carboxyl group of orsellinic acid is lost before the ester linkage with the w-phenyl-polyene carboxylic acid or its precursor is formed. Chemicals used in the process included various isotopically labeled precursors such as [1-14C]acetate, [2-14C]acetate, [1-14C]butyrate, and [1-13C]propionate, as well as reagents for chemical degradation and analysis like lithium aluminum hydride, ozone, and p-bromo-phenacyl bromide. The study employed techniques such as mass spectrometry, NMR spectroscopy, and high-performance liquid chromatography to analyze the distribution of radioactivity and isotopic enrichment in the synthesized flexirubin and its degradation products.

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