| SpectraBase Compound ID | CI1qdKpW1JI |
|---|---|
| InChI | InChI=1S/C19H46N2O4SSi4/c1-27(2,3)20-16(18(22)24-29(7,8)9)13-14-26-15-17(21-28(4,5)6)19(23)25-30(10,11)12/h16-17,20-21H,13-15H2,1-12H3/t16-,17-/m0/s1 |
| InChIKey | UCHYCIWAEYBTEB-IRXDYDNUSA-N |
| Mol Weight | 511.0 g/mol |
| Molecular Formula | C19H46N2O4SSi4 |
| Exact Mass | 510.225535 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LCXgnff996m |
|---|---|
| Name | Cystathionine, 4tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 510.225535279 u |
| Formula | C19H46N2O4SSi4 |
| InChI | InChI=1S/C19H46N2O4SSi4/c1-27(2,3)20-16(18(22)24-29(7,8)9)13-14-26-15-17(21-28(4,5)6)19(23)25-30(10,11)12/h16-17,20-21H,13-15H2,1-12H3/t16-,17-/m0/s1 |
| InChIKey | UCHYCIWAEYBTEB-IRXDYDNUSA-N |
| Molecular Weight | 510.987 g/mol |
| SMILES | C([C@@](C(=O)O[Si](C)(C)C)(N[Si](C)(C)C)[H])CSC[C@@](C(=O)O[Si](C)(C)C)(N[Si](C)(C)C)[H] |