| SpectraBase Compound ID | 2SoJMFRgGk6 |
|---|---|
| InChI | InChI=1S/C12H20N4O6S.N/c1-4(18)15-8-5(16-12(13)14)2-7(11(21)22)23-10(8)9(20)6(19)3-17;/h2,5-6,8-10,17,19-20H,3H2,1H3,(H,15,18)(H,21,22)(H4,13,14,16);/q;+1/p-1/t5-,6+,8+,9+,10+;/m0./s1 |
| InChIKey | LNVZGRHERNQWAB-VCFRRRQNSA-M |
| Mol Weight | 361.37 g/mol |
| Molecular Formula | C12H19N5O6S |
| Exact Mass | 361.105605 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GjS1FaZGVG8 |
|---|---|
| Name | AMMONIUM_5-ACETAMIDO-2,6-ANHYDRO-3,4,5-TRIDEOXY-4-GUANIDINO-6-THIO-D-GLYCERO-D-GALACTO-NON-2-ENOATE |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C12H19N5O6S |
| InChI | InChI=1S/C12H20N4O6S.N/c1-4(18)15-8-5(16-12(13)14)2-7(11(21)22)23-10(8)9(20)6(19)3-17;/h2,5-6,8-10,17,19-20H,3H2,1H3,(H,15,18)(H,21,22)(H4,13,14,16);/q;+1/p-1/t5-,6+,8+,9+,10+;/m0./s1 |
| InChIKey | LNVZGRHERNQWAB-VCFRRRQNSA-M |
| Literature Reference Author | G.B.KOK,M.CAMPBELL,B.MACKEY,M.VONITZSTEIN |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,2811(1996) |
| Literature Reference DOI | 10.1039/p19960002811 |
| Molecular Weight | 361.373 g/mol |
| Solvent | D2O |
| Source File Reference | UWMZ3167 |