23567-05-7 , Anhydro-2,3,4-tri-O-benzoyl-b-D-glucopyranose,
CAS:23567-05-7
C27H22O8 / 474.5
三苯甲酰基-1,6-脱水-β-D-葡萄糖,
CAS Number | 23567-05-7 |
Product Name | 1,6-Anhydro-2,3,4-tri-O-benzoyl-D-glucopyranose |
IUPAC Name | [(1R,2R,3S,4R,5R)-3,4-dibenzoyloxy-6,8-dioxabicyclo[3.2.1]octan-2-yl] benzoate |
Molecular Formula | C27H22O8 |
Molecular Weight | 474.5 g/mol |
InChI | InChI=1S/C27H22O8/c28-24(17-10-4-1-5-11-17)33-21-20-16-31-27(32-20)23(35-26(30)19-14-8-3-9-15-19)22(21)34-25(29)18-12-6-2-7-13-18/h1-15,20-23,27H,16H2/t20-,21-,22+,23-,27-/m1/s1 |
InChI Key | PUALUCOESOGESO-GWQOTCSHSA-N |
SMILES | C1C2C(C(C(C(O1)O2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5 |
Canonical SMILES | C1C2C(C(C(C(O1)O2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5 |
Isomeric SMILES | C1[C@@H]2[C@H]([C@@H]([C@H]([C@H](O1)O2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5 |
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