常雁, 再帕尔.阿不力孜, 李立军, 方起程. FAB-MS/MS法研究4(20)-双键5/7/6型紫杉烷类二萜化合物的质谱裂解特征J. 药学学报, 2000, 35(7): 526-530.
引用本文: 常雁, 再帕尔.阿不力孜, 李立军, 方起程. FAB-MS/MS法研究4(20)-双键5/7/6型紫杉烷类二萜化合物的质谱裂解特征J. 药学学报, 2000, 35(7): 526-530.
CHANG Yan, ABLIZ Zeper, LI Li-Jun, FANG Qi-Cheng. FRAGMENTATION BEHAVIOR OF 4(20)-METHYLENE 5/7/6 TYPE TAXOIDS BY FAB-MS/MSJ. Acta Pharmaceutica Sinica, 2000, 35(7): 526-530.
Citation: CHANG Yan, ABLIZ Zeper, LI Li-Jun, FANG Qi-Cheng. FRAGMENTATION BEHAVIOR OF 4(20)-METHYLENE 5/7/6 TYPE TAXOIDS BY FAB-MS/MSJ. Acta Pharmaceutica Sinica, 2000, 35(7): 526-530.

FAB-MS/MS法研究4(20)-双键5/7/6型紫杉烷类二萜化合物的质谱裂解特征

FRAGMENTATION BEHAVIOR OF 4(20)-METHYLENE 5/7/6 TYPE TAXOIDS BY FAB-MS/MS

  • 摘要: 目的 研究4(20)-双键5/7/6型紫杉烷类二萜化合物的质谱裂解特征,以及取代基种类及位置对质谱裂解的影响,探讨该类化合物的质谱裂解规律。方法 利用FAB技术测定该类型3种化合物的[M+H]+和[M+Na]+等不同加合离子,以及由其产生的特征碎片离子的CID-MS/MS谱,并对有关特征离子进行了高分辨测定。结果 C-10位为BzO取代的化合物1和2主要以[M+Na]+离子形式存在,该离子主要进行失去HOBz的裂解反应,而C-10位为OH基的化合物3主要以[M+H]+离子形式存在,该离子以失去1个和2个H2O的裂解反应为主导。另外,化合物1和3最终裂解产生m/z 237离子,而化合物2产生m/z 253离子。结论 MS/MS技术可以有效地进行结构差异甚微的相关化合物的结构解析。

     

    Abstract: AIM To investigate the fragmentation behavior of three 4(20)-methylene 5/7/6 type taxoids, and the influence of types and positions of the substituents on fragmentation. METHODS The CID-MS/MS spectra of adduct ions such as [M+H]+ and [M+Na]+ were measured by FAB, as well as some related characteristic ions. In addition, the high-resolution data of characteristic ions were determined. RESULTS The loss of HOBz is the major mode of decomposition of [M+Na]+ ion for compounds 1 (brevifoliol) and 2 (taxchinin A), while [M+H]+ ion of 3 (7-acetyl-10-deacetyl-7-debenzoylbrevifoliol) mainly undergoes the decomposition reactions of expelling one or two H2O molecules. After loss of all AcO and BzO and some OH groups, 1 and 3 produce fragment ion with stable conjugated system at m/z 237, and 2 at m/z 253. CONCLUSION The related compounds with slight structural difference can be effectively differentiated using MS/MS technique.

     

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