| SpectraBase Compound ID | LNNwBuRaF5F |
|---|---|
| InChI | InChI=1S/C17H17NO9/c19-12(20)5-13(21)25-7-11-14(22)15(23)16(24)17(27-11)26-10-6-18-9-4-2-1-3-8(9)10/h1-4,6,11,14,16-18,22,24H,5,7H2,(H,19,20)/t11-,14-,16-,17-/m1/s1 |
| InChIKey | HZZHOGRFRUCYQW-MDNXKNQGSA-N |
| Mol Weight | 379.32 g/mol |
| Molecular Formula | C17H17NO9 |
| Exact Mass | 379.090331 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K7rSKcLFJZ9 |
|---|---|
| Name | ISATAN-A;1H-INDOL-3-YL-(6'-O-CARBOXYACETYL)-BETA-D-RIBOHEX-3'-ULOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H17NO9 |
| InChI | InChI=1S/C17H17NO9/c19-12(20)5-13(21)25-7-11-14(22)15(23)16(24)17(27-11)26-10-6-18-9-4-2-1-3-8(9)10/h1-4,6,11,14,16-18,22,24H,5,7H2,(H,19,20)/t11-,14-,16-,17-/m1/s1 |
| InChIKey | HZZHOGRFRUCYQW-MDNXKNQGSA-N |
| Literature Reference Author | C.OBERRTHUER,B.SCHNEIDER,H.GRAF,M.HAMBURGER |
| Literature Reference Citation | CHEM.BIODIV.,1,174(2004) |
| Literature Reference DOI | 10.1002/cbdv.200490009 |
| Molecular Weight | 379.323 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU21606 |