basic_info |
|
| Product_Name: | BIOTIN-SIALYL LEWISX TETRASACCHARIDE |
| EnglishSynonyms: | SIALYL LEWIS-X-TETRASACCHRIDE BIOTIN ; NEU5ACA2-2GALB1-4FUCA1-2GLCNAC-BIOTIN ; BIOTIN-SIALYL LEWISX TETRASACCHARIDE |
| pro_mdlNumber: | MFCD03452869 |
| pro_acceptors: | 29 |
| pro_donors: | 16 |
| pro_smile: | C[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](OC([C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O[C@@]4(C[C@@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)NC(=O)C)OC(=O)CCCC[C@H]5[C@@H]6[C@H](CS5)NC(=O)N6)CO)O)O)O |
| InChi: | InChI=1S/C41H66N4O25S/c1-13-26(54)29(57)30(58)37(63-13)67-32-20(11-48)65-36(66-22(53)7-5-4-6-21-23-16(12-71-21)44-40(62)45-23)25(43-15(3)50)34(32)68-38-31(59)35(28(56)19(10-47)64-38)70-41(39(60)61)8-17(51)24(42-14(2)49)33(69-41)27(55)18(52)9-46/h13,16-21,23-38,46-48,51-52,54-59H,4-12H2,1-3H3,(H,42,49)(H,43,50)(H,60,61)(H2,44,45,62)/t13-,16+,17+,18-,19-,20-,21+,23+,24-,25-,26+,27-,28+,29+,30-,31-,32-,33-,34-,35+,36?,37-,38+,41+/m1/s1 |
| InChiKey: | InChIKey=KMRCOTQLRIZCQH-SLSPTQBZSA-N |
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