108739-67-9, Ethyl 2,3,4,6-tetra-O-benzyl-b-D-thioglucopyranoside,
CAS:108739-67-9
C36H40O5S / 584.77
MFCD13182858
乙基-2,3,4,6-O-四苄基-β-D-硫代葡萄糖苷,
CAS Number | 108739-67-9 |
Product Name | (2R,3R,4S,5R,6S)-3,4,5-Tris(benzyloxy)-2-((benzyloxy)methyl)-6-(ethylthio)tetrahydro-2H-pyran |
IUPAC Name | (2S,3R,4S,5R,6R)-2-ethylsulfanyl-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxane |
Molecular Formula | C36H40O5S |
Molecular Weight | 584.77 g/mol |
InChI | InChI=1S/C36H40O5S/c1-2-42-36-35(40-26-31-21-13-6-14-22-31)34(39-25-30-19-11-5-12-20-30)33(38-24-29-17-9-4-10-18-29)32(41-36)27-37-23-28-15-7-3-8-16-28/h3-22,32-36H,2,23-27H2,1H3/t32-,33-,34+,35-,36+/m1/s1 |
InChI Key | NRALMNQUAKWSMF-GJXDWMKPSA-N |
SMILES | CCSC1C(C(C(C(O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5 |
Synonyms | Ethyl 2,3,4,6-Tetrakis-O-(phenylmethyl)-1-thio-β-D-glucopyranoside |
Canonical SMILES | CCSC1C(C(C(C(O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5 |
Isomeric SMILES | CCS[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5 |
CAS No: 108739-67-9 MDL No: MFCD13182858 Chemical Formula: C36H40O5S Molecular Weight: 584.77 |
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