Cyclocommunol

Base Information

• Chemical Name: Cyclocommunol
• CAS No.: 145643-96-5
• Molecular Formula: C20H16 O6
• Molecular Weight: 352.34
• DSSTox Substance ID: DTXSID801317731
• Wikidata: Q105286533
• Pharos Ligand ID: CSNZ151ZKL3N
• Metabolomics Workbench ID: 24020
• ChEMBL ID: CHEMBL4164003
• Mol file: 145643-96-5.mol

Synonyms:Cyclocommunol;145643-96-5;3,8,10-trihydroxy-6-(2-methylprop-1-enyl)-6H-chromeno[4,3-b]chromen-7-one;CHEMBL4164003;3,8,10-Trihydroxy-6-(2-methyl-1-propenyl)-6H,7H-[1]benzopyrano[4,3-b][1]benzopyran-7-one;SCHEMBL7694675;CHEBI:175506;DTXSID801317731;BDBM50291297;LMPK12110937;AKOS040761555;FS-7738;3,8,10-Trihydroxy-6-(2-methyl-1-propenyl)-6H,7H-[1]benzopyrano[4,3-b]benzopyran-7-one, 9CI

Chemical Property of Cyclocommunol

Chemical Property:

• Boiling Point: 628.2±55.0 °C(Predicted)
• PKA: 6.95±0.40(Predicted)
• PSA: 100.13000
• Density: 1.53±0.1 g/cm3(Predicted)
• LogP: 3.97650
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 352.09468823
• Heavy Atom Count: 26
• Complexity: 649

Purity/Quality:

HPLC≥98% ^*data from raw suppliers

Cyclocommunol 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CC1C2=C(C3=C(O1)C=C(C=C3)O)OC4=CC(=CC(=C4C2=O)O)O)C