| SpectraBase Spectrum ID |
3vZItFyxrAU |
| Name |
7H-Purine, 6-chloro-7-(2,3,4,6-tetra-o-acetyl-.beta.-D-glucopyranosyl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
484.099705963 u |
| Formula |
C19H21ClN4O9 |
| InChI |
InChI=1S/C19H21ClN4O9/c1-8(25)29-5-12-14(30-9(2)26)15(31-10(3)27)16(32-11(4)28)19(33-12)24-7-23-18-13(24)17(20)21-6-22-18/h6-7,12,14-16,19H,5H2,1-4H3/t12-,14-,15+,16-,19-/m1/s1 |
| InChIKey |
PPEPBYBRXBEKCB-IIRRGFMQSA-N |
| Molecular Weight |
484.849 g/mol |
| SMILES |
[C@@]1(N2C=3C(=NC=NC3Cl)N=C2)([C@@]([C@@](OC(=O)C)([C@@]([C@](O1)(COC(=O)C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H] |
