| SpectraBase Spectrum ID |
1rtqtgZ0mu |
| Name |
D-Xylitol, 1-C-(6-amino-9H-purin-9-yl)-2,5-anhydro-1-S-(2-methylpropyl)-1-thio- |
| CAS Registry Number |
40031-69-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H21N5O3S |
| InChI |
InChI=1S/C14H21N5O3S/c1-7(2)4-23-14(11-10(21)8(20)3-22-11)19-6-18-9-12(15)16-5-17-13(9)19/h5-8,10-11,14,20-21H,3-4H2,1-2H3,(H2,15,16,17) |
| InChIKey |
BTZKQKBPTJRHBQ-UHFFFAOYSA-N |
| Molecular Weight |
339.414 g/mol |
| SMILES |
Nc1c2c([n](C(C3C(C(CO3)O)O)SCC(C)C)cn2)ncn1 |
| SPLASH |
splash10-0udr-0970000000-ca4249063914fc593d89 |
| Source of Spectrum |
AU-24-241-9 |
| Synonyms |
1-(6-Aminopurin-9-yl)-2,5-anhydro-1-deoxy-1-S-isobutyl-1-thio-aldehydo-D-xylose aldehydrol
1-C-(6-amino-9H-purin-9-yl)-2,5-anhydro-1-S-isobutyl-1-thiopentitol |
| Wiley ID |
1334326 |
