Products 1801433-90-8

CAS 1801433-90-8 appears in our catalog under these names: Biliatresone, Biliatresone/ 99.48% (existing batch purity), Biliatresone, 99.48%. Offered by: GLPBio, TargetMol, Biosynth, Chemat, MedChemExpress. Available pack sizes: 10mg, 25mg, 5mg, 50mg, 1mg, 100mg, 25 mg, 5 mg.

Structural formula: {0} (CAS {1})

Biliatresone is a member of the class of benzodioxoles that is 1,3-benzodioxole which is substituted at positions 5 by a 2-(2-hydroxyphenyl)-3-oxoprop-1-en-3-yl group and at positions 4 and 6 by methoxy groups. A very rare type of isoflavonoid-related 1,2-diaryl-2-propenone found in Dysphania glomulifera (red crumbweed) and D. littoralis, the enone moiety is particularly reactive, undergoing ready Michael addition of water and methanol. Biliatresone has been found to cause extrahepatic biliary atresia (obliteration or discontinuity of the extrahepatic biliary system, resulting in obstruction to bile flow) in a zebrafish model. It has a role as a toxin and a plant metabolite. It is a member of phenols, an aromatic ether, a member of benzodioxoles, an enone and an aromatic ketone.

Source: ChEBI

Identity
Molecular formulaC18H16O6
Molecular weight328.3 g/mol
IUPAC name1-(4,6-dimethoxy-1,3-benzodioxol-5-yl)-2-(2-hydroxyphenyl)prop-2-en-1-one
InChIKeySIKIIXNKUAAGAM-UHFFFAOYSA-N
SMILESCOC1=C(C(=C2C(=C1)OCO2)OC)C(=O)C(=C)C3=CC=CC=C3O

Computed by PubChem (NCBI)