basic_info |
|
| Product_Name: | 3'-BETA-SIALYL-N-ACETYLLACTOSAMINE |
| CAS: | 81693-22-3 |
| EnglishSynonyms: | 3'-BETA-SIALYL-N-ACETYLLACTOSAMINE ; NEU5NACB2->3GALB1->4GLCNAC |
| pro_mdlNumber: | MFCD00797625 |
| pro_acceptors: | 21 |
| pro_donors: | 13 |
| pro_smile: | CC(=O)N[C@@H]1[C@H](C[C@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](OC([C@@H]([C@H]3O)NC(=O)C)O)CO)CO)O)O |
| InChi: | InChI=1S/C25H42N2O19/c1-7(31)26-13-9(33)3-25(24(40)41,45-20(13)15(35)10(34)4-28)46-21-16(36)11(5-29)43-23(18(21)38)44-19-12(6-30)42-22(39)14(17(19)37)27-8(2)32/h9-23,28-30,33-39H,3-6H2,1-2H3,(H,26,31)(H,27,32)(H,40,41)/t9-,10+,11+,12+,13+,14+,15+,16-,17+,18+,19+,20+,21-,22?,23-,25+/m0/s1 |
| InChiKey: | InChIKey=GVXWGQLSDZJHFY-KDAHYMKLSA-N |
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