| SpectraBase Compound ID | A6tnl8KsUJg |
|---|---|
| InChI | InChI=1S/C37H65N11O11S2/c1-18(39)24(50)15-26(52)47-28(19(2)49)33(57)48-34(59-37-30(54)29(53)27(41)20(3)58-37)31(55)36-46-23(17-61-36)35-45-22(16-60-35)32(56)44-12-6-8-21(40)14-25(51)43-13-7-11-42-10-5-4-9-38/h16-21,24,27-31,34,37,42,49-50,53-55H,4-15,38-41H2,1-3H3,(H,43,51)(H,44,56)(H,47,52)(H,48,57) |
| InChIKey | ZFRQNKRBJQEKSA-UHFFFAOYSA-N |
| Mol Weight | 904.1 g/mol |
| Molecular Formula | C37H65N11O11S2 |
| Exact Mass | 903.430644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4IK9y2whXcW |
|---|---|
| Name | W-Peptide |
| CAS Registry Number | 70518-45-5 |
| Comments | PH = 6.5 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C37H65N11O11S2 |
| InChI | InChI=1S/C37H65N11O11S2/c1-18(39)24(50)15-26(52)47-28(19(2)49)33(57)48-34(59-37-30(54)29(53)27(41)20(3)58-37)31(55)36-46-23(17-61-36)35-45-22(16-60-35)32(56)44-12-6-8-21(40)14-25(51)43-13-7-11-42-10-5-4-9-38/h16-21,24,27-31,34,37,42,49-50,53-55H,4-15,38-41H2,1-3H3,(H,43,51)(H,44,56)(H,47,52)(H,48,57) |
| InChIKey | ZFRQNKRBJQEKSA-UHFFFAOYSA-N |
| Instrument Name | Varian XL-100 |
| Literature Reference | F.T. Greenaway, J.C. Dabrowiak, Org. Magn. Resonance 13, 270 (1980). |
| NMR Standard | TMS-PRSO3 Na |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |