![N(6)-BENZOYL-9-[3'-O-(METHYLSULFONYL)-BETA-D-ERYTHRO-FURANOSYL]-ADENINE](/api/spectrum/2inJSPN3oNx/structure.png?h=300&w=458 "N(6)-BENZOYL-9-[3'-O-(METHYLSULFONYL)-BETA-D-ERYTHRO-FURANOSYL]-ADENINE")
| SpectraBase Compound ID | FK2ZPxKDzWz |
|---|---|
| InChI | InChI=1S/C17H17N5O6S/c1-29(25,26)28-11-7-27-17(13(11)23)22-9-20-12-14(18-8-19-15(12)22)21-16(24)10-5-3-2-4-6-10/h2-6,8-9,11,13,17,23H,7H2,1H3,(H,18,19,21,24)/t11-,13-,17-/m0/s1 |
| InChIKey | SZUQFYHWTONXAY-BNLOLNQZSA-N |
| Mol Weight | 419.41 g/mol |
| Molecular Formula | C17H17N5O6S |
| Exact Mass | 419.089954 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2inJSPN3oNx |
|---|---|
| Name | N(6)-BENZOYL-9-[3'-O-(METHYLSULFONYL)-BETA-D-ERYTHRO-FURANOSYL]-ADENINE |
| Compound Number | 9B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H17N5O6S |
| InChI | InChI=1S/C17H17N5O6S/c1-29(25,26)28-11-7-27-17(13(11)23)22-9-20-12-14(18-8-19-15(12)22)21-16(24)10-5-3-2-4-6-10/h2-6,8-9,11,13,17,23H,7H2,1H3,(H,18,19,21,24)/t11-,13-,17-/m0/s1 |
| InChIKey | SZUQFYHWTONXAY-BNLOLNQZSA-N |
| Literature Reference Author | M.FERENCIC,G.REDDY,X.WU,S.GUNTHA,J.NANDY,R.KRISHNAMURTHY,A.E SCHENMOSER |
| Literature Reference Citation | CHEM.BIODIV.,1,939(2004) |
| Literature Reference DOI | 10.1002/cbdv.200490083 |
| Molecular Weight | 419.412 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMS21499 |