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Bischloroanthrabenzoxocinone

Bischloroanthrabenzoxocinone structure

Bischloroanthrabenzoxocinone 

structure
  • CAS No:

    866022-28-8

  • Formula:

    C28H24Cl2O7

  • Chemical Name:

    Bischloroanthrabenzoxocinone

  • Synonyms:

    (-)-bischloroanthrabenzoxocinone;CHEMBL463906;BDBM50250484

Bischloroanthrabenzoxocinone Basic Attributes

543.39196

542.089908

DTXSID10722781

Characteristics

105

Bischloroanthrabenzoxocinone Use and Manufacturing

Bischloroanthrabenzoxocinone ((-)BABX) is a selective inhibitor of Type II fatty acid synthesis (FASII). BABX showed IC50 values of 11.4 and 35.3 μg/ml in the S. aureus and E. coli FASII assays, respectively, with comparable antibacterial activities. FASII is essential to bacterial cell viability and is a promising target for the development of novel antibiotics. More recently, BABX has been shown to inhibit agonist binding to Liver X receptors (LXR). These receptors regulate the expression of the ABCA1 gene, which mediates the efflux of cholesterol from cells.

Computed Properties

Molecular Weight:391.2
XLogP3:7.3
Hydrogen Bond Acceptor Count:2
Exact Mass:390.0214350
Monoisotopic Mass:390.0214350
Topological Polar Surface Area:26.3
Heavy Atom Count:27
Complexity:669
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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