2-(4-β-D-glucopyranosyloxy-3-hydroxyphenyl)-2-(4-β-D-glucopyranosyloxyphenyl)propane

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-(4-β-D-glucopyranosyloxy-3-hydroxyphenyl)-2-(4-β-D-glucopyranosyloxyphenyl)propane
• 英文别名: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[2-[3-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propan-2-yl]phenoxy]oxane-3,4,5-triol
• 化学式: C₂₇H₃₆O₁₃
• 分子量: 568.575
• InChiKey: HRTAVUXSGHMZAE-PCIRLDFKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0
• 重原子数：
  40
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  219
• 氢给体数：
  9
• 氢受体数：
  13

反应信息

• 作为产物：
  描述：

  双酚A 、 alkaline earth salt of/the/ methylsulfuric acid 在 6-benzyl-aminopurine 、 蔗糖 作用下， 以 水 为溶剂， 反应 72.0h， 生成 bisphenol A di-β-D-glucopyranoside 、 2-(4-β-D-glucopyranosyloxy-3-hydroxyphenyl)-2-(4-β-D-glucopyranosyloxyphenyl)propane 、 2-(4-β-D-glucopyranosyloxy-3-hydroxyphenyl)-2-(3-β-D-glucopyranosyloxy-4-hydroxyphenyl)propane
  参考文献：
  名称：

  Phytoremediation of bisphenol A by cultured suspension cells of Eucalyptus perriniana-regioselective hydroxylation and glycosylation

  摘要：

  On biotransformation of bisphenol A by cultured suspension cells of Eucalyptus perriniana, three new biotransformation products, 2,2-bis(4-beta-D-glucopyranosyloxyphenyl)propane, 2-(4-beta-D-glucopyranosyloxy-3-hydroxyphenyl)-2-(4-beta-D-glucopyranosyloxyphenyl)propane and 2-(4-beta-D-glucopyranosyloxy-3-hydroxyphenyl)-2-(3-beta-D-glucopyranosyloxy-4-hydroxyphenyl)propane were isolated after three days incubation. Cultured suspension cells of E. perriniana are capable of regioselective hydroxylation and glycosylation of bisphenol A. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(02)00647-0

文献信息

• Phytoremediation of bisphenol A by cultured suspension cells of Eucalyptus perriniana-regioselective hydroxylation and glycosylation
  作者：Hiroki Hamada、Ryotoku Tomi、Yoshihisa Asada、Tsutomu Furuya

  DOI：10.1016/s0040-4039(02)00647-0

  日期：2002.5

  On biotransformation of bisphenol A by cultured suspension cells of Eucalyptus perriniana, three new biotransformation products, 2,2-bis(4-beta-D-glucopyranosyloxyphenyl)propane, 2-(4-beta-D-glucopyranosyloxy-3-hydroxyphenyl)-2-(4-beta-D-glucopyranosyloxyphenyl)propane and 2-(4-beta-D-glucopyranosyloxy-3-hydroxyphenyl)-2-(3-beta-D-glucopyranosyloxy-4-hydroxyphenyl)propane were isolated after three days incubation. Cultured suspension cells of E. perriniana are capable of regioselective hydroxylation and glycosylation of bisphenol A. (C) 2002 Elsevier Science Ltd. All rights reserved.