Glycoside J-4

Base Information

• Chemical Name: Glycoside J-4
• CAS No.: 94921-23-0
• Molecular Formula: C44H68O20S
• Molecular Weight: 949.078
• Wikidata: Q105168720

Synonyms:Glycoside J-4;(1beta,3beta)-1-((2-O-(6-Deoxy-alpha-L-mannopyranosyl)-4-O-sulfo-alpha-L-arabino pyranosyl)oxy)spirosta-5,25(27)-dien-3-yl-beta-D-glucopyranoside;94921-23-0;beta-D-Glucopyranoside, (1-beta,3-beta)-1-((2-O-(6-deoxy-alpha-L-mannopyranosyl)-4-O-sulfo-alpha-L-arabinopyranosyl)oxy)spirosta-5,25(27)-dien-3-yl;C44H68O20S;C44-H68-O20-S

Chemical Property of Glycoside J-4

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 307.66000
• Density: 1.52g/cm³
• LogP: 0.65200
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 20
• Rotatable Bond Count: 9
• Exact Mass: 948.40246573
• Heavy Atom Count: 65
• Complexity: 1900

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C2C(CC3C2(CCC4C3CC=C5C4(C(CC(C5)OC6C(C(C(C(O6)CO)O)O)O)OC7C(C(C(CO7)OS(=O)(=O)O)O)OC8C(C(C(C(O8)C)O)O)O)C)C)OC19CCC(=C)CO9
• Isomeric SMILES: C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC=C5[C@@]4([C@@H](C[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O[C@H]7[C@@H]([C@H]([C@H](CO7)OS(=O)(=O)O)O)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)C)C)O[C@]19CCC(=C)CO9

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