![9-[4-(DIPHOSPHORYLOXYPHOSPHONYLMETHOXY)-CYCLOPENT-2-ENYL]-GUANINE](/api/spectrum/BriIiK2swb6/structure.png?h=300&w=458 "9-[4-(DIPHOSPHORYLOXYPHOSPHONYLMETHOXY)-CYCLOPENT-2-ENYL]-GUANINE")
| SpectraBase Compound ID | 2k50dwx9x0t |
|---|---|
| InChI | InChI=1S/C11H16N5O11P3/c12-11-14-9-8(10(17)15-11)13-4-16(9)6-1-2-7(3-6)25-5-28(18,19)26-30(23,24)27-29(20,21)22/h1-2,4,6-7H,3,5H2,(H,18,19)(H,23,24)(H2,20,21,22)(H3,12,14,15,17)/t6-,7+/m0/s1 |
| InChIKey | FBSKDDHRSQBRNC-NKWVEPMBSA-N |
| Mol Weight | 487.19 g/mol |
| Molecular Formula | C11H16N5O11P3 |
| Exact Mass | 487.005917 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BriIiK2swb6 |
|---|---|
| Name | 9-[4-(DIPHOSPHORYLOXYPHOSPHONYLMETHOXY)-CYCLOPENT-2-ENYL]-GUANINE |
| Compound Number | VA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C11H12N5O11P3 |
| InChI | InChI=1S/C11H16N5O11P3/c12-11-14-9-8(10(17)15-11)13-4-16(9)6-1-2-7(3-6)25-5-28(18,19)26-30(23,24)27-29(20,21)22/h1-2,4,6-7H,3,5H2,(H,18,19)(H,23,24)(H2,20,21,22)(H3,12,14,15,17)/t6-,7+/m0/s1 |
| InChIKey | FBSKDDHRSQBRNC-NKWVEPMBSA-N |
| Literature Reference Author | A.L.KHANDAZHINSKAYA,E.A.SHIROKOVA,Y.S.SKOBLOV,L.S.VICTOROVA, L.Y.GORYUNOVA,R.S.BE |
| Literature Reference Citation | J.MED.CHEM.,45,1284(2002) |
| Literature Reference DOI | 10.1021/jm011011l |
| Solvent | D2O |
| Source File Reference | UWLU64467 |