| SpectraBase Compound ID | LLtsNwMar2R |
|---|---|
| InChI | InChI=1S/C20H24O9S/c1-11(21)25-10-16-17(26-12(2)22)18(27-13(3)23)19(28-14(4)24)20(29-16)30-15-8-6-5-7-9-15/h5-9,16-20H,10H2,1-4H3/t16-,17-,18+,19-,20+/m1/s1 |
| InChIKey | JCKOUAWEMPKIAT-OBKDMQGPSA-N |
| Mol Weight | 440.46 g/mol |
| Molecular Formula | C20H24O9S |
| Exact Mass | 440.114104 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JnjcqGhASh6 |
|---|---|
| Name | Phenyl 2,3,4,6-tetra-O-acetyl-1-thio-b-D-glucopyranoside |
| Alternate Name(s) | (2R,3R,4S,5R,6S)-2-(acetoxymethyl)-6-(phenylthio)tetrahydro-2H-pyran-3,4,5-triyl triacetate Acetic acid [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-(phenylthio)-2-oxanyl]methyl ester [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-phenylsulfanyloxan-2-yl]methyl acetate [(2R,3R,4S,5R,6S)-3,4,5-triacetoxy-6-phenylsulfanyl-tetrahydropyran-2-yl]methyl acetate [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-phenylsulfanyl-oxan-2-yl]methyl ethanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H24O9S |
| InChI | InChI=1S/C20H24O9S/c1-11(21)25-10-16-17(26-12(2)22)18(27-13(3)23)19(28-14(4)24)20(29-16)30-15-8-6-5-7-9-15/h5-9,16-20H,10H2,1-4H3/t16-,17-,18+,19-,20+/m1/s1 |
| InChIKey | JCKOUAWEMPKIAT-OBKDMQGPSA-N |
| Literature Reference DOI | 10.1021/ol202270g |
| Molecular Weight | 440.463 g/mol |
| SMILES | [C@@]1([C@]([C@](OC(C)=O)([C@@](OC(C)=O)([C@](Sc2ccccc2)(O1)[H])[H])[H])(OC(C)=O)[H])(COC(C)=O)[H] |
| SPLASH | splash10-066r-0900000000-1525bfd729545b5badb3 |
| Source of Spectrum | A1-13-5544/SMS18-40a |
| Wiley ID | 1753826 |