| SpectraBase Spectrum ID |
7yGH9usQQmi |
| Name |
9-(5,6-Dideoxy-6-(p-toluenesulfonyl)-.beta.-D-ribo-hexofuranosyl)adenine |
| Alternate Name(s) |
(2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-{2-[(4-methylbenzene)sulfonyl]ethyl}oxolane-3,4-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21N5O5S |
| InChI |
InChI=1S/C18H21N5O5S/c1-10-2-4-11(5-3-10)29(26,27)7-6-12-14(24)15(25)18(28-12)23-9-22-13-16(19)20-8-21-17(13)23/h2-5,8-9,12,14-15,18,24-25H,6-7H2,1H3,(H2,19,20,21)/t12-,14-,15-,18-/m1/s1 |
| InChIKey |
URLBAIMRQXSBIG-SCFUHWHPSA-N |
| Molecular Weight |
419.456 g/mol |
| SMILES |
O[C@@]1([C@](O[C@]([C@@]1(O)[H])([n]1c2c(c(N)ncn2)nc1)[H])(CCS(c1ccc(cc1)C)(=O)=O)[H])[H] |
| SPLASH |
splash10-000b-0790000000-dfca8a2958fa4f69137f |
| Source of Spectrum |
I-69-337-6 |
| Wiley ID |
1377546 |
