| SpectraBase Compound ID | 41AfZskbg4w |
|---|---|
| InChI | InChI=1S/C33H50N5O25P/c1-11(40)34-19-4-5-38(31(55)37-19)28-25(50)24(49)18(60-28)10-59-64(56,57)63-33(30(53)54)7-15(44)21(36-13(3)42)27(62-33)23(48)17(46)9-58-32(29(51)52)6-14(43)20(35-12(2)41)26(61-32)22(47)16(45)8-39/h4-5,14-18,20-28,39,43-50H,6-10H2,1-3H3,(H,35,41)(H,36,42)(H,51,52)(H,53,54)(H,56,57)(H,34,37,40,55)/t14-,15-,16+,17+,18-,20+,21+,22+,23+,24-,25-,26+,27+,28-,32+,33+/m0/s1 |
| InChIKey | VKOQTHWUNKBNJT-YKUVYZLRSA-N |
| Mol Weight | 947.7 g/mol |
| Molecular Formula | C33H50N5O25P |
| Exact Mass | 947.253249 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1jZ0N0GAu7G |
|---|---|
| Name | CYTIDINE-5'-MONOPHOSPHORYL-N-ACETYLNEURAMINYL-(2->9)-N-ACETYLNEURAMINIC-ACID |
| Compound Number | 71 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H49N5O25P |
| InChI | InChI=1S/C33H50N5O25P/c1-11(40)34-19-4-5-38(31(55)37-19)28-25(50)24(49)18(60-28)10-59-64(56,57)63-33(30(53)54)7-15(44)21(36-13(3)42)27(62-33)23(48)17(46)9-58-32(29(51)52)6-14(43)20(35-12(2)41)26(61-32)22(47)16(45)8-39/h4-5,14-18,20-28,39,43-50H,6-10H2,1-3H3,(H,35,41)(H,36,42)(H,51,52)(H,53,54)(H,56,57)(H,34,37,40,55)/t14-,15-,16+,17+,18-,20+,21+,22+,23+,24-,25-,26+,27+,28-,32+,33+/m0/s1 |
| InChIKey | VKOQTHWUNKBNJT-YKUVYZLRSA-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 | D2O |
| Source File Reference | UWLU30814 |