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Combretastatin A-4 phosphate, CA4DP, CA4P

康普瑞汀磷酸二钠康布瑞汀磷酸二钠Chemical Name: 2-Methoxy-5-[2(Z)-(3,4,5-trimethoxyphenyl)vinyl]phenoxyphosphoric acid disodium salt; Disodium combretastatin A-4 3-O-phosphate
CAS No. 168555-66-6, 229027-07-0 (deleted CAS), 222030-63-9 (free acid)
项目整合开发状态: Phase II
项目研究机构: OxiGene (Orphan Drug), Arizona State University (Originator), OxiGene (Licensee)
合成路线:Reaction of 3,4,5-trimethoxybenzyl alcohol (I) with LiBr/Me3SiCl gives the benzylic bromide (II),which is further condensed with triphenylphosphine to provide the phosphonium salt (III).Wittig reaction of (III) with 4-methoxy-3-(thexyldimethylsilyloxy)benzaldehyde (thexyl is the acronym of 1,1,2-trimethylpropyl) derivative (IV) produces the cis-stilbene (V).Subsequent desilylation of (V) by means of tetrabutylammonium fluoride leads to combretastatin A4 (VI) (1).Phosphitylation of the phenolic hydroxyl group of (VI) with di-tert-butyl N,N-diethylphosphoramidite in the presence of tetrazol provides phosphite ester (VII),which is oxidized by means of m-CPBA to yield phosphate (VIII).The tert-butyl phosphate ester groups of (VIII) are finally cleaved employing trifluoroacetic acid to furnish the desired combretastatin A4 phosphate (1-3).

合成路线:In an alternative method,3-hydroxy-4-methoxybenzaldehyde (I) is converted to the corresponding imine (II) with butylamine and p-toluenesulfonic acid.Phosphitylation of (II),followed by oxidation with m-CPBA leads to the aldehyde phosphate (III).This is then subjected to Wittig reaction with 3,4,5-trimethoxybenzyl triphenylphosphonium bromide (IV) to produce the stilbene derivative (V).Finally,acidic cleavage of the tert-butyl ester groups of (V) yields combretastatin phosphate.

合成路线:Reaction of 3,4,5-trimethoxybenzyl alcohol (I) with LiBr/Me3SiCl gives the benzylic bromide (II),which is further condensed with triphenylphosphine to provide the phosphonium salt (III).Wittig reaction of (III) with 4-methoxy-3-(thexyldimethylsilyloxy)benzaldehyde (thexyl is the acronym of 1,1,2-trimethylpropyl) derivative (IV) produces the cis-stilbene (V).Subsequent desilylation of (V) by means of tetrabutylammonium fluoride leads to combretastatin A4.
📌 参考资料/链接:
参考文献标题:Substd.diphenylethylenes and analogues or derivs.thereof
文献作者:Rathbone,D.L.; Slack,J.A.; Griffin,R.J.; Quarterman,C.P.(Aston Molecules Ltd.)
参考来源:WO 9216486

📄 详细内容


合成路线:Similarly,combretastatin A4 (I) is phosphorylated employing bis (2,2,2-trichloroethyl) phosphorochloridate (II) to afford phosphate (III).Reductive cleavage of the trichloroethyl ester groups of (III) by means of Zn/AcOH,followed by passage through a cation exchange resin furnishes the target sodium phosphate salt.

参考文献标题:Combretastatin A-4 prodrug
文献作者:Pettit,G.R.(Arizona State University)
参考来源:US 5561122


合成路线:Reaction of 3,4,5-trimethoxybenzyl alcohol (I) with LiBr/Me3SiCl gives the benzylic bromide (II),which is further condensed with triphenylphosphine to provide the phosphonium salt (III).Wittig reaction of (III) with 4-methoxy-3-(thexyldimethylsilyloxy)benzaldehyde (thexyl is the acronym of 1,1,2-trimethylpropyl) derivative (IV) produces the cis-stilbene (V).Subsequent desilylation of (V) by means of tetrabutylammonium fluoride leads to combretastatin A4 (VI) (1).Phosphitylation of the phenolic hydroxyl group of (VI) with di-tert-butyl N,N-diethylphosphoramidite in the presence of tetrazol provides phosphite ester (VII),which is oxidized by means of m-CPBA to yield phosphate (VIII).The tert-butyl phosphate ester groups of (VIII) are finally cleaved employing trifluoroacetic acid to furnish the desired combretastatin A4 phosphate (1-3).

合成路线:A related phosphorylation of combretastatin A4 (I) is carried out by coupling with dibenzyl phosphite (A) in the presence of CCl4 and DMAP to furnish phosphate (II).The benzyl phosphate esters of (II) are removed by treatment with NaI/Me3SiCl to afford combretastatin A4 phosphate (III),which is finally converted to the corresponding disodium salt with sodium methoxide in MeOH (2-4).Alternatively,phosphitylation of combretastatin A4 (I) with bis(trimethylsilylethoxy) N,N-diisopropyl phosphoramidite (B),followed by oxidation with m-CPBA affords phosphate (IV).The silylethoxy ester groups of (IV) are then removed with tetrabutylammonium fluoride to yield combretastatin A4 phosphate (III) (2,3).

参考文献标题:Synthesis of combretastatin A-4 prodrugs and trans-isomers thereof
文献作者:Pettit,G.R.; Rhodes,M.R.(Arizona State University)
参考来源:WO 9935150


合成路线:A related phosphorylation of combretastatin A4 (I) is carried out by coupling with dibenzyl phosphite (A) in the presence of CCl4 and DMAP to furnish phosphate (II).The benzyl phosphate esters of (II) are removed by treatment with NaI/Me3SiCl to afford combretastatin A4 phosphate (III),which is finally converted to the corresponding disodium salt with sodium methoxide in MeOH (2-4).Alternatively,phosphitylation of combretastatin A4 (I) with bis(trimethylsilylethoxy) N,N-diisopropyl phosphoramidite (B),followed by oxidation with m-CPBA affords phosphate (IV).The silylethoxy ester groups of (IV) are then removed with tetrabutylammonium fluoride to yield combretastatin A4 phosphate (III) (2,3).

参考文献标题:Efficient method of synthesizing combretastatin A-4 prodrugs
文献作者:Seyedi,F.; Gale,J.; Haider,R.; Hoare,J.(OxiGene,Inc.)
参考来源:US 2002119951; WO 0206279


合成路线:Similarly,combretastatin A4 (I) is phosphorylated employing bis (2,2,2-trichloroethyl) phosphorochloridate (II) to afford phosphate (III).Reductive cleavage of the trichloroethyl ester groups of (III) by means of Zn/AcOH,followed by passage through a cation exchange resin furnishes the target sodium phosphate salt.

参考文献标题:Antineoplastic agents 322.Synthesis of combretastatin A-4 prodrugs
文献作者:Bansal,N.; Boyd,M.R.; Narayanan,V.L.; Pettit,G.R.; Rener,G.A.; Simpson,M.J.; Temple,C.Jr.; Varma,R.
参考来源:Anti-Cancer Drug Des 1995,10(4),299


合成路线:Reaction of 3,4,5-trimethoxybenzyl alcohol (I) with LiBr/Me3SiCl gives the benzylic bromide (II),which is further condensed with triphenylphosphine to provide the phosphonium salt (III).Wittig reaction of (III) with 4-methoxy-3-(thexyldimethylsilyloxy)benzaldehyde (thexyl is the acronym of 1,1,2-trimethylpropyl) derivative (IV) produces the cis-stilbene (V).Subsequent desilylation of (V) by means of tetrabutylammonium fluoride leads to combretastatin A4 (VI) (1).Phosphitylation of the phenolic hydroxyl group of (VI) with di-tert-butyl N,N-diethylphosphoramidite in the presence of tetrazol provides phosphite ester (VII),which is oxidized by means of m-CPBA to yield phosphate (VIII).The tert-butyl phosphate ester groups of (VIII) are finally cleaved employing trifluoroacetic acid to furnish the desired combretastatin A4 phosphate (1-3).

合成路线:A related phosphorylation of combretastatin A4 (I) is carried out by coupling with dibenzyl phosphite (A) in the presence of CCl4 and DMAP to furnish phosphate (II).The benzyl phosphate esters of (II) are removed by treatment with NaI/Me3SiCl to afford combretastatin A4 phosphate (III),which is finally converted to the corresponding disodium salt with sodium methoxide in MeOH (2-4).Alternatively,phosphitylation of combretastatin A4 (I) with bis(trimethylsilylethoxy) N,N-diisopropyl phosphoramidite (B),followed by oxidation with m-CPBA affords phosphate (IV).The silylethoxy ester groups of (IV) are then removed with tetrabutylammonium fluoride to yield combretastatin A4 phosphate (III) (2,3).
参考文献标题:Antineoplastic agents 389.New syntheses of combretastatin A-4 prodrug
文献作者:Pettit,G.R.; Rhodes,M.R.
参考来源:Anti-Cancer Drug Des 1998,13(3),183


产品链接: CAS No. 168555-66-6››

产品链接: CAS No.222030-63-9››