(4-(beta-D-Glucopyranosyloxy)Phenyl)(4-Nitrophenyl)Methanone Hydrate
[CAS# 83354-86-3]

Identification

• Name: (4-(beta-D-Glucopyranosyloxy)Phenyl)(4-Nitrophenyl)Methanone Hydrate
• Synonyms: (4-Nitrophenyl)-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxyphenyl]Methanone; (4-Nitrophenyl)-[4-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Phenyl]Methanone; (4-Nitrophenyl)-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxyphenyl]Methanone
• Molecular Formula: C₁₉H₁₉NO₉
• Molecular Weight: 405.36
• CAS Registry Number: 83354-86-3
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)OC3=CC=C(C(=O)C2=CC=C([N+]([O-])=O)C=C2)C=C3
• InChI: 1S/C19H19NO9/c21-9-14-16(23)17(24)18(25)19(29-14)28-13-7-3-11(4-8-13)15(22)10-1-5-12(6-2-10)20(26)27/h1-8,14,16-19,21,23-25H,9H2/t14-,16-,17+,18-,19-/m1/s1
• InChIKey: XDTVKCFMTFAIDV-IQZDNPOKSA-N