ALD00034

(S)-tert-Butyl 1-(chloromethyl)-5-hydroxy-1H-benzo[e]indole-3(2H)-carboxylate

95% (HPLC)

• 别名: N-Boc-seco-CBI
• 经验公式（希尔记法）: C₁₈H₂₀ClNO₃
• CAS号: 130007-86-2
• 分子量: 333.81
• MDL编号: MFCD29059844
• UNSPSC代码: 12352200
• PubChem化学物质编号: 329772532
• NACRES: NA.22

属性

• 方案: 95% (HPLC)
• 表单: powder
• 旋光性: [α]/D -89.0, c = 0.05% in chloroform
• 储存温度: −20°C
• SMILES字符串: OC1=C2C(C=CC=C2)=C3C(N(C(OC(C)(C)C)=O)C[C@H]3CCl)=C1
• InChI: 1S/C18H20ClNO3/c1-18(2,3)23-17(22)20-10-11(9-19)16-13-7-5-4-6-12(13)15(21)8-14(16)20/h4-8,11,21H,9-10H2,1-3H3/t11-/m1/s1
• InChI key: DGPQGWRHSMFTSW-LLVKDONJSA-N

说明

应用

N-Boc-CBI best used as its seco precursor (seco-N-Boc-CBI) is a simple alkylation subunit analog of that found in the naturally occurring antitumor agents the duocarmycins, yatakemycin, and CC-1065, which act by sequence selective DNA alkylation.

其他说明

Design, Synthesis, and Evaluation of Duocarmycin O-Amino Phenol Prodrugs Subject to Tunable Reductive Activation

安全信息

• 象形图: GHS07,GHS09
• 警示用语：: Warning
• 危险声明: H302,H410
• 预防措施声明: P273 - P501
• 危险分类: Acute Tox. 4 Oral - Aquatic Acute 1 - Aquatic Chronic 1
• 储存分类代码: 11 - Combustible Solids
• WGK: WGK 3
• 闪点(°F): Not applicable
• 闪点(°C): Not applicable