Dictyostatin-1

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酯类和类似物
• 英文名称: Dictyostatin-1
• 英文别名: (3Z,5E,7R,8R,10R,11Z,13R,14S,15S,21R,22R)-22-[(2R,3Z)-hexa-3,5-dien-2-yl]-8,10,14,20-tetrahydroxy-7,13,15,17,21-pentamethyl-1-oxacyclodocosa-3,5,11-trien-2-one
• 化学式: C₃₂H₅₂O₆
• 分子量: 532.8
• InChiKey: OFPZNTXZCGKCMU-VXUABRCOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.5
• 重原子数：
  38
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.66
• 拓扑面积：
  107
• 氢给体数：
  4
• 氢受体数：
  6

文献信息

• ANALOGS OF DICODERMOLIDE AND DICTYOSTATIN-1, INTERMEDIATES THEREFOR AND METHODS OF SYNTHESIS THEREOF
  申请人：CURRAN DENNIS P.

  公开号：US20090036691A1

  公开（公告）日：2009-02-05

  A compound of the following structure: wherein R 1 is H, an alkyl group, an aryl group, an alkenyl group, an alkynyl group, or a halogen atom; R 2 is H, an alkyl group, an aryl group, a benzyl group, a trityl group, —SiR a R b R c , CH 2 OR d , or COR e ; R a , R b and R c are independently an alkyl group or an aryl group; R d is an alkyl group, an aryl group, an alkoxylalkyl group, —R i SiR a R b R c or a benzyl group, wherein R i is an alkylene group; R e is an alkyl group, an allyl group, a benzyl group, an aryl group, an alkoxy group, or —NR g R h , wherein R g and R h are independently H, an alkyl group or an aryl group; R 3 is (CH 2 ) n where n is and integer in the range of 0 to 5, —CH 2 CH(CH 3 )—, —CH═CH—, —CH═C(CH 3 )—, or —C≡C—; R 4 , wherein y1 and y2 are 1 and y3, y4 and y5 are independently 0 or 1, R k1 , R k2 , R k3 , R k4 and R k5 are independently H, CH 3 , or OR 2a , and R s1 , R s2 , R s3 , and R s4 are independently H or CH 3 , wherein R 2a is H, an alkyl group, an aryl group, a benzyl group, a trityl group, —SiR a R b R c , CH 2 OR d , or COR e ; and R 5 is H or OR 2b , wherein R 2b is H, an alkyl group, an aryl group, an aryl group, a benzyl group, a trityl group, —SiR a R b R c , CH 2 OR d , or COR e .

  以下为结构式的化合物： 其中R1为H、烷基、芳基、烯基、炔基或卤素原子； R2为H、烷基、芳基、苯甲基、三苯甲基、—SiRaRbRc、CH2ORd或CORe； Ra、Rb和Rc独立地为烷基或芳基； Rd为烷基、芳基、烷氧基烷基、—RiSiRaRbRc或苯甲基，其中Ri为烷基； Re为烷基、烯丙基、苯甲基、芳基、烷氧基或—NRgRh，其中Rg和Rh独立地为H、烷基或芳基； R3为(CH2)n，其中n为0至5的整数，—CH2CH(CH3)—、—CH═CH—、—CH═C(CH3)—或—C≡C—； R4为H或OR2b，其中y1和y2为1，y3、y4和y5独立地为0或1，Rk1、Rk2、Rk3、Rk4和Rk5独立地为H、CH3或OR2a，而Rs1、Rs2、Rs3和Rs4独立地为H或CH3，其中R2a为H、烷基、芳基、苯甲基、三苯甲基、—SiRaRbRc、CH2ORd或CORe；而R2b为H、烷基、芳基、苯甲基、三苯甲基、—SiRaRbRc、CH2ORd或CORe。
• Analogs of dictyostatin, intermediates therefor and methods of systhesis thereof
  申请人：Curran Dennis P.

  公开号：US20080188651A1

  公开（公告）日：2008-08-07

  Dictyostatin and its analogs show great promise as new anticancer agents. The present invention provides dictyostatin analogs, synthetic intermediates for the synthesis of dictyostatin analogs, and synthetic methods for the synthesis of such analogs and intermediates. Dictyostatin analogs can have the following structure or its enantiomer wherein R 1 is H, an alkyl group, an aryl group, an alkenyl group, an alkynyl group, or a halogen atom; R 2 is H, a protecting group, an alkyl group, a benzyl group, a trityl group, —SiR a R b R c , CH 2 OR d , or COR e ; R a , R b and R c are independently an alkyl group or an aryl group; R d is an alkyl group, an aryl group, an alkoxylalkyl group, —R i SiR a R b R c or a benzyl group, wherein R i is an alkylene group; R e is an alkyl group, an allyl group, a benzyl group, an aryl group, an alkoxy group, or —NR g R h , wherein R g and R h are independently H, an alkyl group or an aryl group; R 3 is (CH 2 ) n where n is and integer in the range of 0 to 5, —CH 2 CH(CH 3 ), —CH═CH—, —CH═C(CH 3 ), or —C≡C—; R 4 is wherein R 23a is H, a protecting group, an alkyl group, a benzyl group, a trityl group, —SiR a R b R c , CH 2 OR d , or COR e , R 23b is H, a protecting group, an alkyl group, a benzyl group, a trityl group, —SiR a R b R c , CH 2 OR d , or COR e , or R 23a and R 23b together form a portion of six-membered acetal ring incorporating CR t R u ; R t and R u are independently H, an alkyl group, an aryl group or an alkoxyaryl group; and R 5 is H or OR 2b , wherein R 2b is H, a protecting group, an alkyl group, an aryl group, a benzyl group, a trityl group, —SiR a R b R c , CH 2 OR d , or COR e ; provided that the compound is not dictyostatin 1.

  Dictyostatin及其类似物作为新的抗癌剂表现出极大的潜力。本发明提供Dictyostatin类似物，用于合成Dictyostatin类似物的合成中间体，以及用于合成此类类似物和中间体的合成方法。Dictyostatin类似物可以具有以下结构或其对映异构体，其中R1为H、烷基、芳基、烯基、炔基或卤素原子；R2为H、保护基、烷基、苯甲基、三苯基甲基、-SiRaRbRc、CH2ORd或CORe；Ra、Rb和Rc独立地为烷基或芳基；Rd为烷基、芳基、烷氧基烷基、-RiSiRaRbRc或苯甲基，其中Ri为烷基；Re为烷基、烯丙基、苯甲基、芳基、烷氧基或-NRgRh，其中Rg和Rh独立地为H、烷基或芳基；R3为（CH2）n，其中n为0至5之间的整数，-CH2CH（CH3）、-CH═CH-、-CH═C（CH3）或-C≡C-；R4为其中R23a为H、保护基、烷基、苯甲基、三苯基甲基、-SiRaRbRc、CH2ORd或CORe，R23b为H、保护基、烷基、苯甲基、三苯基甲基、-SiRaRbRc、CH2ORd或CORe，或R23a和R23b一起形成包含CRtRu的六元缩醛环的一部分；Rt和Ru独立地为H、烷基、芳基或烷氧基芳基；R5为H或OR2b，其中R2b为H、保护基、烷基、芳基、苯甲基、三苯基甲基、-SiRaRbRc、CH2ORd或CORe；前提是该化合物不是Dictyostatin 1。
• US7321046B2
  申请人：——

  公开号：US7321046B2

  公开（公告）日：2008-01-22
• US7968736B2
  申请人：——

  公开号：US7968736B2

  公开（公告）日：2011-06-28