| SpectraBase Compound ID | dBRTJAKHs4 |
|---|---|
| InChI | InChI=1S/C21H33N3O15/c25-7-4-1-22-19(34)16-14(32)11(29)8(26)5(38-16)2-24-21(36)18-15(33)12(30)9(27)6(39-18)3-23-20(35)17(37-4)13(31)10(7)28/h4-18,25-33H,1-3H2,(H,22,34)(H,23,35)(H,24,36)/t4-,5-,6-,7-,8-,9-,10+,11+,12+,13-,14-,15-,16-,17-,18-/m0/s1 |
| InChIKey | YTILXYHZQWIZRW-YMRLFKCKSA-N |
| Mol Weight | 567.5 g/mol |
| Molecular Formula | C21H33N3O15 |
| Exact Mass | 567.191167 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C0DJ0YauOVo |
|---|---|
| Name | CYCLO-(GLUCOSYLURONIC-ACID-METHYLAMINE)3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H33N3O15 |
| InChI | InChI=1S/C21H33N3O15/c25-7-4-1-22-19(34)16-14(32)11(29)8(26)5(38-16)2-24-21(36)18-15(33)12(30)9(27)6(39-18)3-23-20(35)17(37-4)13(31)10(7)28/h4-18,25-33H,1-3H2,(H,22,34)(H,23,35)(H,24,36)/t4-,5-,6-,7-,8-,9-,10+,11+,12+,13-,14-,15-,16-,17-,18-/m0/s1 |
| InChIKey | YTILXYHZQWIZRW-YMRLFKCKSA-N |
| Literature Reference Author | E.LOCARDI,M.STOECKLE,S.GRUNER,H.KESSLER |
| Literature Reference Citation | J.AM.CHEM.SOC.,123,8189(2001) |
| Literature Reference DOI | 10.1021/ja010181k |
| Molecular Weight | 567.504 g/mol |
| Solvent | H2O:D2O |
| Source File Reference | UWLU33275 |