| SpectraBase Compound ID | 1WbN7Ta4Aoe |
|---|---|
| InChI | InChI=1S/C9H18N4O16P4/c10-5-1-2-13(9(15)11-5)8-6(14)7(4(27-8)3-26-32(20,21)22)28-30(16,17)12-31(18,19)29-33(23,24)25/h1-2,4,6-8,14H,3H2,(H2,10,11,15)(H2,20,21,22)(H2,23,24,25)(H3,12,16,17,18,19)/t4-,6-,7-,8-/m1/s1 |
| InChIKey | FZNYEFODUHEAEP-XVFCMESISA-N |
| Mol Weight | 562.15 g/mol |
| Molecular Formula | C9H18N4O16P4 |
| Exact Mass | 561.966828 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9AydSdl5Y8u |
|---|---|
| Name | 3'-DIPHOSPHOR-AMIDO-PHOSPHONO-CYTIDINE-5'-MONOPHOSPHATE |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C9H12N4O16P4 |
| InChI | InChI=1S/C9H18N4O16P4/c10-5-1-2-13(9(15)11-5)8-6(14)7(4(27-8)3-26-32(20,21)22)28-30(16,17)12-31(18,19)29-33(23,24)25/h1-2,4,6-8,14H,3H2,(H2,10,11,15)(H2,20,21,22)(H2,23,24,25)(H3,12,16,17,18,19)/t4-,6-,7-,8-/m1/s1 |
| InChIKey | FZNYEFODUHEAEP-XVFCMESISA-N |
| Literature Reference Author | H.MAEDA,T.CHIBA,M.TSUHAKO,H.NAKAYAMA |
| Literature Reference Citation | CHEM.PHARM.BULL.,56,1698(2008) |
| Literature Reference DOI | 10.1248/cpb.56.1698 |
| Solvent | D2O |
| Source File Reference | UWIR2498 |