SpectraBase Spectrum ID |
51Iny4eruc3 |
Name |
6-[(p-Nitrobenzyl)thio]-9-(2'-O-methyl-.beta.-D-ribofuranosyl)purine |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H19N5O6S |
InChI |
InChI=1S/C18H19N5O6S/c1-28-15-14(25)12(6-24)29-18(15)22-9-21-13-16(22)19-8-20-17(13)30-7-10-2-4-11(5-3-10)23(26)27/h2-5,8-9,12,14-15,18,24-25H,6-7H2,1H3/t12-,14-,15-,18-/m1/s1 |
InChIKey |
RHOHPNZSUJYXEP-SCFUHWHPSA-N |
Molecular Weight |
433.439 g/mol |
SMILES |
O[C@]1([C@]([C@@](O[C@@]1(CO)[H])([n]1c2c(c(SCc3ccc(N(=O)=O)cc3)ncn2)nc1)[H])(OC)[H])[H] |
SPLASH |
splash10-000i-2190300000-5c1b9cabb51e6364b8db |
Source of Spectrum |
J-39-1891-2 |
Synonyms |
(2R,3R,4R,5R)-2-(hydroxymethyl)-4-methoxy-5-(6-{[(4-nitrophenyl)methyl]sulfanyl}-9H-purin-9-yl)oxolan-3-ol |
Wiley ID |
848779 |