![#36B;N(6)-BENZOYL-9-[3'-O-[(2-CYANOETHOXY)-(DIISOPROPYLAMINO)-PHOSPHINO]-2'-DEOXY-2'-N-[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-ALPHA-L-THREO-FURANOSYL]-ADENINE](/api/spectrum/1IVKCNwICUT/structure.png?h=300&w=458 "#36B;N(6)-BENZOYL-9-[3'-O-[(2-CYANOETHOXY)-(DIISOPROPYLAMINO)-PHOSPHINO]-2'-DEOXY-2'-N-[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-ALPHA-L-THREO-FURANOSYL]-ADENINE")
| SpectraBase Compound ID | KU8m5WtbMxa |
|---|---|
| InChI | InChI=1S/2C45H49N8O5P/c2*1-31(2)53(32(3)4)59(57-27-15-26-46)58-38-28-56-44(52-30-49-40-41(47-29-48-42(40)52)50-43(54)33-16-9-6-10-17-33)39(38)51-45(34-18-11-7-12-19-34,35-20-13-8-14-21-35)36-22-24-37(55-5)25-23-36/h2*6-14,16-25,29-32,38-39,44,51H,15,27-28H2,1-5H3,(H,47,48,50,54)/t2*38-,39+,44+,59?/m11/s1 |
| InChIKey | FXYDINXCCMVVEW-AFYBHDHTSA-N |
| Mol Weight | 1625.8 g/mol |
| Molecular Formula | C90H98N16O10P2 |
| Exact Mass | 1624.712707 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1IVKCNwICUT |
|---|---|
| Name | #36B;N(6)-BENZOYL-9-[3'-O-[(2-CYANOETHOXY)-(DIISOPROPYLAMINO)-PHOSPHINO]-2'-DEOXY-2'-N-[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-ALPHA-L-THREO-FURANOSYL]-ADENINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C90H98N16O10P2 |
| InChI | InChI=1S/2C45H49N8O5P/c2*1-31(2)53(32(3)4)59(57-27-15-26-46)58-38-28-56-44(52-30-49-40-41(47-29-48-42(40)52)50-43(54)33-16-9-6-10-17-33)39(38)51-45(34-18-11-7-12-19-34,35-20-13-8-14-21-35)36-22-24-37(55-5)25-23-36/h2*6-14,16-25,29-32,38-39,44,51H,15,27-28H2,1-5H3,(H,47,48,50,54)/t2*38-,39+,44+,59?/m11/s1 |
| InChIKey | FXYDINXCCMVVEW-AFYBHDHTSA-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 | 1625.817 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS21534 |