basic_info |
|
| Product_Name: | ALPHA-1,4-D-N-ACETYL GALACTOSAMINE PENTAMER |
| EnglishSynonyms: | NAGOS-5 ; [A-1,4-D-GALNAC]5 ; N-ACETYLGALACTOSAMINO-PENTAMER ; ALPHA-1,4-D-N-ACETYL GALACTOSAMINE PENTAMER |
| pro_mdlNumber: | MFCD00211120 |
| pro_acceptors: | 31 |
| pro_donors: | 17 |
| pro_smile: | CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@@H]1O)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)O)NC(=O)C)O)NC(=O)C)O)NC(=O)C)O)NC(=O)C)O |
| InChi: | InChI=1S/C40H67N5O26/c1-11(51)41-21-28(58)32(17(7-47)63-36(21)62)68-38-23(43-13(3)53)30(60)34(19(9-49)65-38)70-40-25(45-15(5)55)31(61)35(20(10-50)67-40)71-39-24(44-14(4)54)29(59)33(18(8-48)66-39)69-37-22(42-12(2)52)27(57)26(56)16(6-46)64-37/h16-40,46-50,56-62H,6-10H2,1-5H3,(H,41,51)(H,42,52)(H,43,53)(H,44,54)(H,45,55)/t16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26+,27-,28-,29-,30-,31-,32+,33+,34+,35+,36+,37-,38-,39-,40-/m1/s1 |
| InChiKey: | InChIKey=BZBKTWJIYTYFBH-JOZWBMQESA-N |
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