(4-(beta-D-Glucopyranosyloxy)Phenyl)Phenylmethanone Hemihydrate
[CAS# 83355-65-1]

Identification

• Name: (4-(beta-D-Glucopyranosyloxy)Phenyl)Phenylmethanone Hemihydrate
• Synonyms: Phenyl-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxyphenyl]Methanone; Phenyl-[4-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Phenyl]Methanone; Phenyl-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxyphenyl]Methanone
• Molecular Formula: C₁₉H₂₀O₇
• Molecular Weight: 360.36
• CAS Registry Number: 83355-65-1
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)OC3=CC=C(C(=O)C2=CC=CC=C2)C=C3
• InChI: 1S/C19H20O7/c20-10-14-16(22)17(23)18(24)19(26-14)25-13-8-6-12(7-9-13)15(21)11-4-2-1-3-5-11/h1-9,14,16-20,22-24H,10H2/t14-,16-,17+,18-,19-/m1/s1
• InChIKey: ZCXWHGXLVGHPKE-IQZDNPOKSA-N