![(2R,3R/2S,3S)-N-[(3-TERT.-BUTOXYCARBONYL-AZIRIDINE-2-YL)-CARBONYL]-(S)-LEUCYL-(S)-PROLINE-BENZYLESTER](/api/spectrum/H9m4JCV3Stm/structure.png?h=300&w=458 "(2R,3R/2S,3S)-N-[(3-TERT.-BUTOXYCARBONYL-AZIRIDINE-2-YL)-CARBONYL]-(S)-LEUCYL-(S)-PROLINE-BENZYLESTER")
| SpectraBase Compound ID | ELZ5746ubQ4 |
|---|---|
| InChI | InChI=1S/2C26H37N3O6/c2*1-16(2)14-18(27-22(30)20-21(28-20)25(33)35-26(3,4)5)23(31)29-13-9-12-19(29)24(32)34-15-17-10-7-6-8-11-17/h2*6-8,10-11,16,18-21,28H,9,12-15H2,1-5H3,(H,27,30)/t2*18?,19?,20-,21-/m10/s1 |
| InChIKey | VIGNQCNGAJOKRC-ZKMUIVEWSA-N |
| Mol Weight | 975.2 g/mol |
| Molecular Formula | C52H74N6O12 |
| Exact Mass | 974.536472 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H9m4JCV3Stm |
|---|---|
| Name | (2R,3R/2S,3S)-N-[(3-TERT.-BUTOXYCARBONYL-AZIRIDINE-2-YL)-CARBONYL]-(S)-LEUCYL-(S)-PROLINE-BENZYLESTER |
| Compound Number | 13A+B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H74N6O12 |
| InChI | InChI=1S/2C26H37N3O6/c2*1-16(2)14-18(27-22(30)20-21(28-20)25(33)35-26(3,4)5)23(31)29-13-9-12-19(29)24(32)34-15-17-10-7-6-8-11-17/h2*6-8,10-11,16,18-21,28H,9,12-15H2,1-5H3,(H,27,30)/t2*18?,19?,20-,21-/m10/s1 |
| InChIKey | VIGNQCNGAJOKRC-ZKMUIVEWSA-N |
| Literature Reference Author | T.SCHIRMEISTER,M.PERIC |
| Literature Reference Citation | BIOORG.MED.CHEM.,8,1281(2000) |
| Literature Reference DOI | 10.1016/S0968-0896(00)00058-4 |
| Molecular Weight | 975.193 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN20239 |