Acetophenonehelveticosol

Base Information

• Chemical Name: Acetophenonehelveticosol
• CAS No.: 35811-16-6
• Molecular Formula: C37H50O9
• Molecular Weight: 638.7875
• DSSTox Substance ID: DTXSID20957204

Synonyms:Acetophenonhelveticosol;Acetophenonehelveticosol;Acetophenone helveticosol;Acetophenonhelveticosol [German];35811-16-6;Card-20(22)-enolide, 3-((2,6-dideoxy-3,4-O-((1-phenylethylidene)bis(oxy))-beta-D-ribo-hexopyranosyl)oxy)-5,14,19-trihydroxy-, (3-beta,5-beta)-;acetophenone-helveticosol;DTXSID20957204;QNBADHCGFQKPKR-OMFYFAIKSA-N;C37H50O9;3-{[2,6-Dideoxy-3,4-O-(1-phenylethylidene)hexopyranosyl]oxy}-5,14,19-trihydroxycard-20(22)-enolide

Chemical Property of Acetophenonehelveticosol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 782.9°Cat760mmHg
• Flash Point: 242.9°C
• Density: 1.32g/cm³
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 638.34548317
• Heavy Atom Count: 46
• Complexity: 1230

Purity/Quality:

90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC1C2C(CC(O1)OC3CCC4(C5CCC6(C(CCC6(C5CCC4(C3)O)O)C7=CC(=O)OC7)C)CO)OC(O2)(C)C8=CC=CC=C8
• Isomeric SMILES: CC1[C@@H]2C(C[C@@H](O1)O[C@H]3CC[C@@]4(C5CC[C@@]6([C@H](CC[C@@]6(C5CC[C@@]4(C3)O)O)C7=CC(=O)OC7)C)CO)OC(O2)(C)C8=CC=CC=C8

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