basic_info |
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| Product_Name: | 4-NITROPHENYL 2-ACETAMIDO-2-DEOXY-4-O-(2-ACETAMIDO-2-DEOXY-BETA-D-GALACTOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE |
| CAS: | 872578-72-8 |
| EnglishSynonyms: | GALNAC BETA(1-4)GLCNAC-BETA-PNP ; 4-NITROPHENYL 2-ACETAMIDO-2-DEOXY-4-O-(2-ACETAMIDO-2-DEOXY-BETA-D-GALACTOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE |
| pro_mdlNumber: | MFCD15072176 |
| pro_acceptors: | 16 |
| pro_donors: | 7 |
| pro_smile: | CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)NC(=O)C)Oc3ccc(cc3)[N+](=O)[O-])CO)CO)O)O |
| InChi: | InChI=1S/C22H31N3O13/c1-9(28)23-15-18(31)17(30)13(7-26)36-22(15)38-20-14(8-27)37-21(16(19(20)32)24-10(2)29)35-12-5-3-11(4-6-12)25(33)34/h3-6,13-22,26-27,30-32H,7-8H2,1-2H3,(H,23,28)(H,24,29)/t13-,14-,15-,16-,17+,18-,19-,20-,21-,22+/m1/s1 |
| InChiKey: | InChIKey=HWBFEVWOQMUQIE-BFKOZBEUSA-N |
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