| SpectraBase Compound ID | i3al2bCtiN |
|---|---|
| InChI | InChI=1S/C39H55N4O23P.C6H15N/c1-18(44)40-29-12-13-43(36(52)41-29)34-33(63-24(7)50)32(62-23(6)49)28(64-34)17-58-67(54,55)66-39(35(51)56-11)14-25(31(61-22(5)48)27(60-21(4)47)16-57-19(2)45)30(26(15-39)59-20(3)46)42-37(53)65-38(8,9)10;1-4-7(5-2)6-3/h12-13,25-28,30-34H,14-17H2,1-11H3,(H,42,53)(H,54,55)(H,40,41,44,52);4-6H2,1-3H3/t25-,26+,27+,28+,30+,31+,32+,33+,34+,39-;/m1./s1 |
| InChIKey | SUEWMXGDGVFYOZ-SFGYDLQESA-N |
| Mol Weight | 1080.0 g/mol |
| Molecular Formula | C45H70N5O23P |
| Exact Mass | 1079.419921 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8VTYzuNzp6e |
|---|---|
| Name | #65;TRIETHYLAMMONIUM-4-N-ACETYL-2',3'-DI-O-ACETYL-5'-CYTIDINYL-(METHYL-4,7,8,9-TETRA-O-ACETYL-5-TERT.-BUTOXYCARBONYLAMINO-3,5-DIDEOXY-D-GLYCERO-BETA-D-GALACTO- |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H70N5O23P |
| InChI | InChI=1S/C39H55N4O23P.C6H15N/c1-18(44)40-29-12-13-43(36(52)41-29)34-33(63-24(7)50)32(62-23(6)49)28(64-34)17-58-67(54,55)66-39(35(51)56-11)14-25(31(61-22(5)48)27(60-21(4)47)16-57-19(2)45)30(26(15-39)59-20(3)46)42-37(53)65-38(8,9)10;1-4-7(5-2)6-3/h12-13,25-28,30-34H,14-17H2,1-11H3,(H,42,53)(H,54,55)(H,40,41,44,52);4-6H2,1-3H3/t25-,26+,27+,28+,30+,31+,32+,33+,34+,39-;/m1./s1 |
| InChIKey | SUEWMXGDGVFYOZ-SFGYDLQESA-N |
| Literature Reference Author | M.IZUMI,G.J.SHEN,S.WACOWICH-SGARBI,T.NAKATANI,O.PLETTENBURG, C.H.WONG |
| Literature Reference Citation | J.AM.CHEM.SOC.,123,10909(2001) |
| Literature Reference DOI | 10.1021/ja011382r |
| Solvent | CD3OD |
| Source File Reference | UWLU30810 |