(-)-Canaliculatol

Base Information

• Chemical Name: (-)-Canaliculatol
• CAS No.: 114488-83-4
• Molecular Formula: C42H32 O9
• Molecular Weight: 680.6981
• DSSTox Substance ID: DTXSID201100033
• Wikidata: Q105280816
• Mol file: 114488-83-4.mol

Synonyms:(-)-Canaliculatol;114488-83-4;DTXSID201100033;(2R,2aR,7R,7aR,12R,12aS)-2,2a,7,7a,12,12a-Hexahydro-2,7,12-tris(4-hydroxyphenyl)benz[7,8]indeno[2',1':4,5]cycloocta[1,2,3-cd]benzofuran-4,6,9,11,14-pentol;Benz(7,8)indeno(2',1':4,5)cycloocta(1,2,3-cd)benzofuran-4,6,9,11,14-pentol, 2,2a,7,7a,12,12a-hexahydro-2,7,12-tris(4-hydroxyphenyl)-,(2R,2aR,7R,7aR,12R,12aS)-

Chemical Property of (-)-Canaliculatol

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.51g/cm³
• XLogP3: 6.8
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 3
• Exact Mass: 680.20463259
• Heavy Atom Count: 51
• Complexity: 1190

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2C3C(C(C4=C(C=C(C=C4O)O)C5C(OC6=CC(=CC3=C56)O)C7=CC=C(C=C7)O)C8=CC=C(C=C8)O)C9=C2C(=CC(=C9)O)O)O