| SpectraBase Spectrum ID |
C0muTYSGFCS |
| Name |
2-[6-(2-Amino-6-oxo-1,6-dihydro-purin-9-yl)-hexylsulfanylcarbonyl]-3-iodo-2-methyl-propionic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H24IN5O4S |
| InChI |
InChI=1S/C17H24IN5O4S/c1-17(9-18,14(25)27-2)15(26)28-8-6-4-3-5-7-23-10-20-11-12(23)21-16(19)22-13(11)24/h10H,3-9H2,1-2H3,(H3,19,21,22,24) |
| InChIKey |
WCXOAXIODQQWCZ-UHFFFAOYSA-N |
| Molecular Weight |
521.374 g/mol |
| SMILES |
N1C(c2c(N=C1N)[n](cn2)CCCCCCSC(C(C(=O)OC)(CI)C)=O)=O |
| SPLASH |
splash10-016r-5941000000-83de7c192c3cfc28c5e5 |
| Source of Spectrum |
H-85-3015-8 |
| Synonyms |
Methyl 3-[6'-{2''-amino-1'',6''-dihydro-6''-oxo-9H-purin-9''-yl}hexylthio]-2-(iodomethyl)-2-methylpropanoate
Methyl 3-{[6-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)hexyl]sulfanyl}-2-(iodomethyl)-2-methyl-3-oxopropanoate |
| Wiley ID |
1524643 |
![2-[6-(2-Amino-6-oxo-1,6-dihydro-purin-9-yl)-hexylsulfanylcarbonyl]-3-iodo-2-methyl-propionic acid methyl ester](/api/spectrum/C0muTYSGFCS/structure.png?h=300&w=458 "2-[6-(2-Amino-6-oxo-1,6-dihydro-purin-9-yl)-hexylsulfanylcarbonyl]-3-iodo-2-methyl-propionic acid methyl ester")
