| SpectraBase Spectrum ID |
8pQNAXydwWc |
| Name |
N-Phenacyl-N'-(2,3,4-tri-O-acetyl-.beta.D-glucopyranosyl)thiourea |
| Alternate Name(s) |
2,3,4-tri-O-acetyl-N-{[(2-oxo-2-phenylethyl)amino]carbothioyl}-.beta.-D-xylo-hexopyranosylamine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26N2O9S |
| InChI |
InChI=1S/C21H26N2O9S/c1-11(25)29-17-16(10-24)32-20(19(31-13(3)27)18(17)30-12(2)26)23-21(33)22-9-15(28)14-7-5-4-6-8-14/h4-8,16-20,24H,9-10H2,1-3H3,(H2,22,23,33)/t16-,17-,18+,19-,20-/m1/s1 |
| InChIKey |
VKVVXIAHNMCCRW-OUUBHVDSSA-N |
| Molecular Weight |
482.504 g/mol |
| SMILES |
N([C@@]1(O[C@](CO)([C@]([C@@]([C@]1(OC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])[H])[H])C(NCC(=O)c1ccccc1)=S |
| SPLASH |
splash10-0bvm-9500000000-dd612ef460fd80db130d |
| Source of Spectrum |
F-48-6420-6 |
| Wiley ID |
1395530 |
