| SpectraBase Spectrum ID |
3OLWAWHkE43 |
| Name |
3-(2,3,4,6-Tetra-O-Acetyl-.beta.-D-glucopyranosylsulfanyl)-5-(1H-indol-2-yl)-1H-1,2,4-triazole |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H26N4O9S |
| InChI |
InChI=1S/C24H26N4O9S/c1-11(29)33-10-18-19(34-12(2)30)20(35-13(3)31)21(36-14(4)32)23(37-18)38-24-26-22(27-28-24)17-9-15-7-5-6-8-16(15)25-17/h5-9,18-21,23,25H,10H2,1-4H3,(H,26,27,28)/t18-,19-,20+,21-,23+/m1/s1 |
| InChIKey |
XONICDXDSVYOCO-VZWAGXQNSA-N |
| Molecular Weight |
546.551 g/mol |
| SMILES |
[nH]1c2ccccc2cc1-c1nc(S[C@]2([C@@]([C@@](OC(=O)C)([C@@]([C@](O2)(COC(=O)C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H])n[nH]1 |
| SPLASH |
splash10-066r-0910000000-57af8e3e6d98b1775c09 |
| Source of Spectrum |
EMC-66-110-9 |
| Synonyms |
3-(2,3,4,6-Tetra-O-Acetyl-.beta.-D-glucopyranosylsulfanyl)-5-(1H-indol-2-yl)-2H-1,2,4-triazole
(2S,3R,4S,5R,6R)-2-((5-(1H-indol-2-yl)-1H-1,2,4-triazol-3-yl)thio)-6-(acetoxymethyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate |
| Wiley ID |
1735489 |
