Methyl 3,4,6-tri-O-galloyl-beta-D-glucopyranoside

Base Information

• Chemical Name: Methyl 3,4,6-tri-O-galloyl-beta-D-glucopyranoside
• CAS No.: 89927-26-4
• Molecular Formula: C₂₈H₂₆O₁₈
• Molecular Weight: 650.504
• Wikidata: Q104991072

Synonyms:Methyl 3,4,6-tri-O-galloyl-b-D-glucopyranoside;Methyl 3,4,6-tri-O-galloyl-beta-D-glucopyranoside

Chemical Property of Methyl 3,4,6-tri-O-galloyl-beta-D-glucopyranoside

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 11
• Exact Mass: 650.11191398
• Heavy Atom Count: 46
• Complexity: 1020

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• Canonical SMILES: COC1C(C(C(C(O1)COC(=O)C2=CC(=C(C(=C2)O)O)O)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O

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