| SpectraBase Compound ID | 3H1KgleRTdo |
|---|---|
| InChI | InChI=1S/C30H66N2O6SSi4/c1-17-18-22-19-23(32(3)20-22)29(33)31-24(21(2)35-40(5,6)7)25-26(36-41(8,9)10)27(37-42(11,12)13)28(30(34-25)39-4)38-43(14,15)16/h21-28,30H,17-20H2,1-16H3,(H,31,33) |
| InChIKey | OXBGDEZMRZAZQA-UHFFFAOYSA-N |
| Mol Weight | 695.3 g/mol |
| Molecular Formula | C30H66N2O6SSi4 |
| Exact Mass | 694.371865 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7XUxjR0AfnZ |
|---|---|
| Name | Lincomycin, 4tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 694.371865161 u |
| Formula | C30H66N2O6SSi4 |
| InChI | InChI=1S/C30H66N2O6SSi4/c1-17-18-22-19-23(32(3)20-22)29(33)31-24(21(2)35-40(5,6)7)25-26(36-41(8,9)10)27(37-42(11,12)13)28(30(34-25)39-4)38-43(14,15)16/h21-28,30H,17-20H2,1-16H3,(H,31,33) |
| InChIKey | OXBGDEZMRZAZQA-UHFFFAOYSA-N |
| SMILES | C1(C(C(C(C(O1)SC)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)C(NC(C1CC(CN1C)CCC)=O)C(C)O[Si](C)(C)C |