| SpectraBase Compound ID | E0TRT1nbPPo |
|---|---|
| InChI | InChI=1S/C19H34N2O15S.Na/c1-8(22)21-10-12(24)11(23)9(7-33-37(29,30)31)34-18(10)35-15-13(25)14(26)19(36-16(15)17(27)28)32-6-4-2-3-5-20;/h9-16,18-19,23-26H,2-7,20H2,1H3,(H,21,22)(H,27,28)(H,29,30,31);/q;+1/p-1/t9-,10-,11+,12-,13+,14+,15-,16-,18+,19+;/m1./s1 |
| InChIKey | MFQNNOWYDCJSLL-WLLUZQIWSA-M |
| Mol Weight | 584.5 g/mol |
| Molecular Formula | C19H33N2NaO15S |
| Exact Mass | 584.149934 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5sbzWO8dhBD |
|---|---|
| Name | 5-AMINOPENTYL-4-O-(2-ACETAMIDO-2-DEOXY-6-O-SULFO-BETA-D-GALACTOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDURONIC-ACID-SODIUM-SALT |
| Compound Number | 16-SODIUM-SALT |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C19H33N2NaO15S |
| InChI | InChI=1S/C19H34N2O15S.Na/c1-8(22)21-10-12(24)11(23)9(7-33-37(29,30)31)34-18(10)35-15-13(25)14(26)19(36-16(15)17(27)28)32-6-4-2-3-5-20;/h9-16,18-19,23-26H,2-7,20H2,1H3,(H,21,22)(H,27,28)(H,29,30,31);/q;+1/p-1/t9-,10-,11+,12-,13+,14+,15-,16-,18+,19+;/m1./s1 |
| InChIKey | MFQNNOWYDCJSLL-WLLUZQIWSA-M |
| Literature Reference Author | G.MACCHIONE,S.MAZA,M.M.KAYSER,J.L.DEPAZ,P.M.NIETO |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2014,3868(2014) |
| Literature Reference DOI | 10.1002/ejoc.201402222 |
| Molecular Weight | 584.525 g/mol |
| Solvent | D2O |
| Source File Reference | UWLU85332 |