6-Isopropoxy-9-oxoxanthene-2-carboxylic acid

Base Information

• Chemical Name: 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid
• CAS No.: 33458-93-4
• Molecular Formula: C17H14 O5
• Molecular Weight: 298.29
• DSSTox Substance ID: DTXSID80187106
• Nikkaji Number: J134.032H
• Wikidata: Q27074359
• Pharos Ligand ID: M1NCKHJHDNW1
• ChEMBL ID: CHEMBL1317823
• Mol file: 33458-93-4.mol

Synonyms:6-isopropoxy-9-oxoxanthene-2-carboxylic acid;AH 6809;AH-6809;AH6809

Chemical Property of 6-Isopropoxy-9-oxoxanthene-2-carboxylic acid

Chemical Property:

• Vapor Pressure: 2.12E-11mmHg at 25°C
• Boiling Point: 514.2°Cat760mmHg
• Flash Point: 192.9°C
• PSA: 76.74000
• Density: 1.334g/cm³
• LogP: 3.43160
• Storage Temp.: Store at RT
• Solubility.: ethanol: 2.5 mg/mL, soluble
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 298.08412354
• Heavy Atom Count: 22
• Complexity: 446

Purity/Quality:

99%, ^*data from raw suppliers

AH 6809 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C)OC1=CC2=C(C=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O
• Description: AH 6809 is an EP and DP receptor antagonist with nearly equal affinity for the cloned human EP1, EP2, EP3-III, and DP1 receptors. AH 6809 blocks the PGE2-induced accumulation of cAMP in COS cells transfected with the human EP2 receptor. It also blocks the accumulation of Ca2+ in Xenopus oocytes expressing the human EP1 receptor. In the human and guinea pig, the activity profile of AH 6809 is similar to that of SC-19220, but it is somewhat more potent. In the mouse, AH 6809 has the highest affinity for the EP2 receptor, but also acts as a weak ligand at the murine EP1 and DP1 receptors. In whole human platelets, AH 6809 is an effective antagonist of the antiaggregatory actions of PGD2, but not PGI2, with an EC50 of about 5 x 10?5 M.
• Uses: AH-6809 is a prostaglandin E2 receptor antagonist.

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