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61169-00-4 , 4-Nitrophenyl 4,6-benzylidene-b-D-glucopyranoside,
CAS:61169-00-4
C19H19NO8 / 389.356
| CAS Number | 61169-00-4 |
| Product Name | 4-Nitrophenyl 4,6-O-benzylidene-b-D-glucopyranoside |
| IUPAC Name | (4aR,6S,7R,8R,8aS)-6-(4-nitrophenoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol |
| Molecular Formula | C19H19NO8 |
| Molecular Weight | 389.356 g/mol |
| InChI | InChI=1S/C19H19NO8/c21-15-16(22)19(26-13-8-6-12(7-9-13)20(23)24)27-14-10-25-18(28-17(14)15)11-4-2-1-3-5-11/h1-9,14-19,21-22H,10H2/t14-,15-,16-,17-,18?,19-/m1/s1 |
| InChI Key | BGBDVEKOBCWPHZ-HIQCEYAYSA-N |
| SMILES | C1C2C(C(C(C(O2)OC3=CC=C(C=C3)[N+](=O)[O-])O)O)OC(O1)C4=CC=CC=C4 |
| Canonical SMILES | C1C2C(C(C(C(O2)OC3=CC=C(C=C3)[N+](=O)[O-])O)O)OC(O1)C4=CC=CC=C4 |
| Isomeric SMILES | C1[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC=C(C=C3)[N+](=O)[O-])O)O)OC(O1)C4=CC=CC=C4 |
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