(2S,3S)-2,3-cis-4',5,7-trihydroxyflavan-3-ol | 36801-69-1

• 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: (2S,3S)-2,3-cis-4',5,7-trihydroxyflavan-3-ol
• 英文别名: (+)-epiafzelechin；epiafzelechin；NP-002325；ent-Epiafzelechin；(2S,3S)-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
• CAS: 36801-69-1
• 化学式: C₁₅H₁₄O₅
• 分子量: 274.273
• InChiKey: RSYUFYQTACJFML-ZFWWWQNUSA-N

物化性质

• 熔点：
  248-251 °C(Solv: ethyl acetate (141-78-6))
• 沸点：
  583.4±50.0 °C(Predicted)
• 密度：
  1.492±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  20
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  90.2
• 氢给体数：
  4
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  2,4,6-tris(O-methoxymethyl)benzaldehyde 在 palladium on activated charcoal 盐酸 、 氢氧化钾 、 AD-mix-α 、 氯化亚砜 、 甲基磺酰胺 、 氢气 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 甲醇 、 乙醇 、 二氯甲烷 、 水 、 叔丁醇 、 苯 为溶剂， 反应 29.58h， 生成 (2S,3S)-2,3-cis-4',5,7-trihydroxyflavan-3-ol
  参考文献：
  名称：

  Nel, Reinier J. J.; Heerden, Pieter S. van; Rensburg, Hendrik van, Journal of Chemical Research, Miniprint, 1999, # 10, p. 2610 - 2625

  摘要：

  DOI：

文献信息

• METHODS OF PREVENTING TUMOR METASTASIS, TREATING AND PROGNOSING CANCER AND IDENTIFYING AGENTS WHICH ARE PUTATIVE METASTASIS INHIBITORS
  申请人：Yeda Research and Development Co. Ltd.

  公开号：US20150290233A1

  公开（公告）日：2015-10-15

  A method of preventing tumor metastasis with the proviso that the tumor is not glioma is provided. The method comprising administering to a subject in need thereof a therapeutically effective amount of an inhibitor of synaptojanin 2 (SYNJ2), thereby preventing tumor metastasis. Also, provided is a method of treating cancer. The method comprising, administering to a subject in need thereof a therapeutically effective amount of an inhibitor of synaptojanin 2 (SYNJ2) and an inhibitor of a cell surface receptor associated with an onset or progression of cancer, thereby treating cancer.
• SYNAPTOJANIN-2 INHIBITORS FOR USE IN THE TREATMENT OF CANCER
  申请人：YEDA RESEARCH AND DEVELOPMENT CO. LTD.

  公开号：US20170042857A1

  公开（公告）日：2017-02-16

  Disclosed herein are synaptojanin-2 inhibitors, and novel methods and uses utilizing same for preventing tumor metastasis, treating cancer or inhibiting synaptojanin-2. Compounds disclosed herein include chlorhexidine and pyrvinium, the compound having the formula: and compounds characterized by the general formula: X-L-[(Y)i-(Z)j]-(L-X)k and/or by the general formula: wherein L, X, Y, Z, D, E, i, j and k are as defined herein.
• [EN] METHODS OF PREVENTING TUMOR METASTASIS, TREATING AND PROGNOSING CANCER AND IDENTIFYING AGENTS WHICH ARE PUTATIVE METASTASIS INHIBITORS<br/>[FR] MÉTHODES DE PRÉVENTION D'UNE MÉTASTASE TUMORALE, DE TRAITEMENT ET DE PRONOSTIC DU CANCER, ET D'IDENTIFICATION D'AGENTS SUSCEPTIBLES DE CONSTITUER DES INHIBITEURS DE MÉTASTASE
  申请人：YEDA RES & DEV

  公开号：WO2014083567A2

  公开（公告）日：2014-06-05

  A method of preventing tumor metastasis with the proviso that the tumor is not glioma is provided. The method comprising administering to a subject in need thereof a therapeutically effective amount of an inhibitor of synaptojanin 2 (SYNJ2), thereby preventing tumor metastasis. Also, provided is a method of treating cancer. The method comprising, administering to a subject in need thereof a therapeutically effective amount of an inhibitor of synaptojanin 2 (SYNJ2) and an inhibitor of a cell surface receptor associated with an onset or progression of cancer, thereby treating cancer.
• [EN] SYNAPTOJANIN-2 INHIBITORS AND USES THEREOF<br/>[FR] INHIBITEURS DE SYNAPTOJANINE-2 ET LEURS UTILISATIONS
  申请人：YEDA RES & DEV

  公开号：WO2015079413A2

  公开（公告）日：2015-06-04

  Disclosed herein are synaptojanin-2 inhibitors, and novel methods and uses utilizing same for preventing tumor metastasis, treating cancer or inhibiting synaptojanin-2. Compounds disclosed herein include chlorhexidine and pyrvinium, the compound having the formula: (I) and compounds characterized by the general formula: X-L-[(Y)i-(Z)j]-(L-X)k and/or by the general formula:(II) wherein L, X, Y, Z, D, E, i, j and k are as defined herein.
• Nel, Reinier J. J.; Heerden, Pieter S. van; Rensburg, Hendrik van, Journal of Chemical Research, Miniprint, 1999, # 10, p. 2610 - 2625
  作者：Nel, Reinier J. J.、Heerden, Pieter S. van、Rensburg, Hendrik van、Ferreira, Daneel

  DOI：——

  日期：——