NB-598 MALEATE(1:1)

CAS号
136719-26-1 ;155294-62-5
CCD编号
CCD07546144
分子式
C27 H31 N O S2 . C4 H4 O4
分子量
565.752

基本信息

产品名称: NB-598 MALEATE(1:1)
CAS: 136719-26-1 ;155294-62-5
英文同义词: NB-598 MALEATE ; NB-598 MALEATE(1:1)
MDL号: MFCD22665748
氢键受体数量: 2
氢键供体数量: 0
Smile: CCN(C/C=C/C#CC(C)(C)C)Cc1cccc(c1)OCc2cc(cs2)c3ccsc3.C(=C\C(=O)O)\C(=O)O
InChi: InChI=1S/C27H31NOS2.C4H4O4/c1-5-28(14-8-6-7-13-27(2,3)4)18-22-10-9-11-25(16-22)29-19-26-17-24(21-31-26)23-12-15-30-20-23;5-3(6)1-2-4(7)8/h6,8-12,15-17,20-21H,5,14,18-19H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b8-6+;2-1-
InChiKey: InChIKey=QGUWPAYJKVJWEK-JVTXGDFZSA-N

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