N,N',N,N''',N'''',N'''''-六乙酰壳六糖

CAS号
38854-46-5
CCD编号
CCD00096716
分子式
C48 H80 N6 O31
分子量
1237.17

基本信息

产品名称: N,N',N,N''',N'''',N'''''-六乙酰壳六糖
CAS: 38854-46-5
中文同义词: N,N',N,N''',N'''',N'''''-六乙酰壳六糖
英文同义词: N,N',N'',N''',N'''',N'''''-HEXAACETYLCHITOHEXAOSE ; GLCNAC-BETA1-4GLCNAC-BETA1-4GLCNAC-BETA1-4GLCNAC-BETA1-4GLCNAC-BETA1-4GLCNAC ; GLCNAC1-BETA-4-GLCNAC1-BETA-4-GLCNAC1-BETA-4GLCNAC1-BETA-4GLCNAC1-BETA-4GLCNAC ; HEXA-N-ACETYLCHITOHEXAOSE ; N,N',N'',N''',N'''',N'''''-HEXA-O-ACETYLCHITOHEXAOSE ; N,N',N,N''',N'''',N'''''-HEXAACETYLCHITOHEXAOSE ; NI, NII, NIII, NIV, NV, NVI-HEXAACETYLCHITOHEXAOSE ; HEXAACETYL-CHITOHEXAOSE
MDL号: MFCD00210241
氢键受体数量: 37
氢键供体数量: 20
Smile: CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](OC1O)CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)NC(=O)C)O)NC(=O)C)O)NC(=O)C)O)NC(=O)C)O)NC(=O)C)O
InChi: InChI=1S/C48H80N6O31/c1-13(61)49-25-33(69)38(20(8-56)75-43(25)74)81-45-27(51-15(3)63)35(71)40(22(10-58)77-45)83-47-29(53-17(5)65)37(73)42(24(12-60)79-47)85-48-30(54-18(6)66)36(72)41(23(11-59)80-48)84-46-28(52-16(4)64)34(70)39(21(9-57)78-46)82-44-26(50-14(2)62)32(68)31(67)19(7-55)76-44/h19-48,55-60,67-74H,7-12H2,1-6H3,(H,49,61)(H,50,62)(H,51,63)(H,52,64)(H,53,65)(H,54,66)/t19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43?,44+,45+,46+,47+,48+/m1/s1
InChiKey: InChIKey=GVTXKCFKWGVHBK-SDEUBOORSA-N

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