3-O-(beta-D-Glucopyranosyl-(1''-6')-2'-acetamido-2'-deoxy-beta-D-glucopyranosyl)olean-12-en-28-oic acid

Base Information

• Chemical Name: 3-O-(beta-D-Glucopyranosyl-(1''-6')-2'-acetamido-2'-deoxy-beta-D-glucopyranosyl)olean-12-en-28-oic acid
• CAS No.: 122881-68-9
• Molecular Formula: C44H71 N O13
• Molecular Weight: 822.0334
• DSSTox Substance ID: DTXSID90924307
• Wikidata: Q82898468

Synonyms:122881-68-9;DTXSID90924307;3-O-(beta-D-Glucopyranosyl-(1''-6')-2'-acetamido-2'-deoxy-beta-D-glucopyranosyl)olean-12-en-28-oic acid;3-({2-Deoxy-6-O-hexopyranosyl-2-[(1-hydroxyethylidene)amino]hexopyranosyl}oxy)olean-12-en-28-oic acid

Chemical Property of 3-O-(beta-D-Glucopyranosyl-(1''-6')-2'-acetamido-2'-deoxy-beta-D-glucopyranosyl)olean-12-en-28-oic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 947.1°C at 760 mmHg
• Flash Point: 526.6°C
• Density: 1.32g/cm³
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 8
• Exact Mass: 821.49254132
• Heavy Atom Count: 58
• Complexity: 1600

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1C(C(C(OC1OC2CCC3(C(C2(C)C)CCC4(C3CC=C5C4(CCC6(C5CC(CC6)(C)C)C(=O)O)C)C)C)COC7C(C(C(C(O7)CO)O)O)O)O)O

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