5,7-dihydroxy-8,2'-dimethoxyflavone 7-O-β-D-glucuronopyranoside methyl ester | 133640-41-2

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 黄酮类化合物
• 英文名称: 5,7-dihydroxy-8,2'-dimethoxyflavone 7-O-β-D-glucuronopyranoside methyl ester
• 英文别名: methyl (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-8-methoxy-2-(2-methoxyphenyl)-4-oxochromen-7-yl]oxyoxane-2-carboxylate
• CAS: 133640-41-2
• 化学式: C₂₄H₂₄O₁₂
• 分子量: 504.447
• InChiKey: OGZVFAAIOHVCIK-YPQORGHUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  36
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  170
• 氢给体数：
  4
• 氢受体数：
  12

反应信息

• 作为产物：
  描述：

  重氮甲烷 、 scutevulin 7-O-β-D-glucuronide 生成 5,7-dihydroxy-8,2'-dimethoxyflavone 7-O-β-D-glucuronopyranoside methyl ester
  参考文献：
  名称：

  Studies on the nepalese crude drugs. XII. On the phenolic compounds from the root of Scutellaria prostrata JAcq. ex Benth.

  摘要：

  From the root of Scutellaria prostrata JACQ. ex BENTH., five compounds (I-V) were isolated, together with three known glycosides of phenylethanoid (IV-VIII) and sixteen known flavonoids (IX-XXIV). On the basis of chemical and spectral evidence, I-V were identified as 5, 6, 2', 6'-tetrahydroxy-7, 8-dimethoxyflavone, 5, 6, 2'-trihydroxy-7, 8, 6'-trimethoxyflavone, 5, 7, 2'-trihydroxy-8-methoxyflavone 7-O-β-D-glucuronopyranoside, 2-(3-hydroxy-4-methoxyphenyl)ethyl 1-O-β-D-glucopyranoside and 2-(3-hydroxy-4-methoxyphenyl)ethyl 1-O-β-D-(4-O-feruloyl)glucopyranoside, respectively. Compound II has already been synthesized.

  DOI：

  10.1248/cpb.39.1047

文献信息

• TOMIMORI, TSUYOSHI;IMOTO, YOSHITAKA;MIYAICHI, YUKINORI, CHEM. AND PHARM. BULL., 38,(1990) N2, C. 3488-3490
  作者：TOMIMORI, TSUYOSHI、IMOTO, YOSHITAKA、MIYAICHI, YUKINORI

  DOI：——

  日期：——