| SpectraBase Compound ID | I47agF8Kp0r |
|---|---|
| InChI | InChI=1S/2C17H19BrN2O7/c2*1-9(21)23-14(18)17-12-11(24-16(25-12)6-3-2-4-7-16)13(26-17)20-8-5-10(22)19-15(20)27-17/h2*5,8,11-14H,2-4,6-7H2,1H3/t11-,12+,13-,14+,17+;11-,12+,13-,14-,17+/m11/s1 |
| InChIKey | BPPKIVPHQXXKLR-HUNSUXRKSA-N |
| Mol Weight | 886.5 g/mol |
| Molecular Formula | C34H38Br2N4O14 |
| Exact Mass | 884.075128 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | INHSJzQOPo1 |
|---|---|
| Name | 4'(S),5'(RS)-O-(2),4'-1-(5-O-ACETYL-2,3-O-CYCLOHEXYLIDENE-5-C-BROMO-BETA-D-ERYTHRO-PENTODIALDOFURANOSYL-4-ULOSE)-URACIL |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H38Br2N4O14 |
| InChI | InChI=1S/2C17H19BrN2O7/c2*1-9(21)23-14(18)17-12-11(24-16(25-12)6-3-2-4-7-16)13(26-17)20-8-5-10(22)19-15(20)27-17/h2*5,8,11-14H,2-4,6-7H2,1H3/t11-,12+,13-,14+,17+;11-,12+,13-,14-,17+/m11/s1 |
| InChIKey | BPPKIVPHQXXKLR-HUNSUXRKSA-N |
| Literature Reference Author | S.L.COOK,J.A.SECRIST |
| Literature Reference Citation | J.AM.CHEM.SOC.,101,1554(1979) |
| Literature Reference DOI | 10.1021/ja00500a031 |
| Molecular Weight | 886.502 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS10730 |