| SpectraBase Compound ID | 5NlQgueW4hV |
|---|---|
| InChI | InChI=1S/C34H48N2O9/c1-5-19-16-35-10-9-21-14-28(43-3)29(44-4)15-23(21)24(35)12-22(19)13-25-30-20(6-7-27(42-2)32(30)39)8-11-36(25)18-34(41)33(40)31(38)26(37)17-45-34/h6-7,14-15,19,22,24-26,31,33,37-41H,5,8-13,16-18H2,1-4H3/t19-,22+,24-,25-,26+,31+,33-,34+/m0/s1 |
| InChIKey | NATGFJZOCKZGKQ-CGCCBIJZSA-N |
| Mol Weight | 628.8 g/mol |
| Molecular Formula | C34H48N2O9 |
| Exact Mass | 628.335981 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3C4tFj5dHbc |
|---|---|
| Name | 2'-N-(1''-DEOXY-1''-BETA-D-FRUCTOPYRANOSYL)-NEOCEPHAELINE |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H48N2O9 |
| InChI | InChI=1S/C34H48N2O9/c1-5-19-16-35-10-9-21-14-28(43-3)29(44-4)15-23(21)24(35)12-22(19)13-25-30-20(6-7-27(42-2)32(30)39)8-11-36(25)18-34(41)33(40)31(38)26(37)17-45-34/h6-7,14-15,19,22,24-26,31,33,37-41H,5,8-13,16-18H2,1-4H3/t19-,22+,24-,25-,26+,31+,33-,34+/m0/s1 |
| InChIKey | NATGFJZOCKZGKQ-CGCCBIJZSA-N |
| Literature Reference Author | A.ITOH,Y.IKUTA,Y.BABA,T.TANAHASHI,N.NAGAKURA |
| Literature Reference Citation | PHYTOCHEM.,52,1169(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00361-1 |
| Molecular Weight | 628.763 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN400 |