| SpectraBase Spectrum ID |
ACObiy2JU1P |
| Name |
[(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-butanoyloxy-tetrahydrofuran-2-yl]methyl butanoate |
| Alternate Name(s) |
[(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-butanoyloxyoxolan-2-yl]methyl butanoate
[(2R,3S,5R)-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-butanoyloxy-oxolan-2-yl]methyl butanoate
Butanoic acid [(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-(1-oxobutoxy)-2-oxolanyl]methyl ester |
| CAS Registry Number |
79971-08-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H25N5O6 |
| InChI |
InChI=1S/C18H25N5O6/c1-3-5-13(24)27-8-11-10(29-14(25)6-4-2)7-12(28-11)23-9-20-15-16(23)21-18(19)22-17(15)26/h9-12H,3-8H2,1-2H3,(H3,19,21,22,26)/t10-,11+,12+/m0/s1 |
| InChIKey |
QKYJOTXTRCUHCM-QJPTWQEYSA-N |
| Molecular Weight |
407.427 g/mol |
| SMILES |
N1C(c2nc[n](c2N=C1N)[C@@]1(O[C@](COC(=O)CCC)([C@](C1)(OC(=O)CCC)[H])[H])[H])=O |
| SPLASH |
splash10-0ff0-9500000000-de5170c2b14ee497717a |
| Source of Spectrum |
C-104-546-0 |
| Wiley ID |
1372509 |
![[(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-butanoyloxy-tetrahydrofuran-2-yl]methyl butanoate](/api/spectrum/ACObiy2JU1P/structure.png?h=300&w=458 "[(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-butanoyloxy-tetrahydrofuran-2-yl]methyl butanoate")
