Sugiresinol

Base Information

• Chemical Name: Sugiresinol
• CAS No.: 2141-07-3
• Molecular Formula: C₁₇H₁₈O₄
• Molecular Weight: 286.328
• Hs Code.: 2932999099
• DSSTox Substance ID: DTXSID80498461
• Metabolomics Workbench ID: 58684
• Nikkaji Number: J14.979I
• Wikidata: Q27124130
• Mol file: 2141-07-3.mol

Synonyms:Sugiresinol;Sequirin A;(-)-sugiresinol;sequirin-A;2141-07-3;CHEBI:53645;(3S)-tetrahydro-4alpha,6alpha-bis(4-hydroxyphenyl)-2H-pyran-3-ol;(1R)-1,5-anhydro-2,3-dideoxy-1,3-bis(4-hydroxyphenyl)-D-threo-pentitol;(3S,4S,6R)-4,6-bis(4-hydroxyphenyl)oxan-3-ol;Epitope ID:116877;DTXSID80498461;C20133;Q27124130

Chemical Property of Sugiresinol

Chemical Property:

• PSA: 69.92000
• LogP: 2.70390
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 286.12050905
• Heavy Atom Count: 21
• Complexity: 319

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(COC1C2=CC=C(C=C2)O)O)C3=CC=C(C=C3)O
• Isomeric SMILES: C1[C@H]([C@@H](CO[C@H]1C2=CC=C(C=C2)O)O)C3=CC=C(C=C3)O