Marsdekoiside B

Base Information

• Chemical Name: Marsdekoiside B
• CAS No.: 139953-35-8
• Molecular Formula: C49H76 O17
• Molecular Weight: 937.11754
• DSSTox Substance ID: DTXSID20930673
• Wikidata: Q82906088
• Mol file: 139953-35-8.mol

Synonyms:12-O-benzoyl-dihydrosarcostin-3-O-3-O-methyl-6-deoxy-beta-D-allopyranosyl(1-4)-O-beta-D-oleandropyranosyl(1-4)-O-beta-D-cymaropyranoside;marsdekoiside B

Chemical Property of Marsdekoiside B

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 935.8°C at 760 mmHg
• Flash Point: 262.2°C
• PSA: 230.75000
• Density: 1.32g/cm³
• LogP: 3.14330
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 13
• Exact Mass: 936.50825095
• Heavy Atom Count: 66
• Complexity: 1670

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OC2C(OC(CC2OC)OC3C(OC(CC3OC)OC4CCC5(C(C4)CCC6(C5CC(C7(C6(CCC7(C(C)O)O)O)C)OC(=O)C8=CC=CC=C8)O)C)C)C)O)OC)O

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