| SpectraBase Compound ID | ERqm9DONmo2 |
|---|---|
| InChI | InChI=1S/C31H41N3O7/c1-20(2)26(33-30(39)41-31(3,4)5)27(36)32-24(18-21-13-15-23(35)16-14-21)28(37)34-17-9-12-25(34)29(38)40-19-22-10-7-6-8-11-22/h6-8,10-11,13-16,20,24-26,35H,9,12,17-19H2,1-5H3,(H,32,36)(H,33,39)/t24-,25-,26-/m1/s1 |
| InChIKey | XENVEDZHTOIKLW-TWJOJJKGSA-N |
| Mol Weight | 567.7 g/mol |
| Molecular Formula | C31H41N3O7 |
| Exact Mass | 567.294451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3AjFJJRx5Ia |
|---|---|
| Name | TERT-BUTYLOXYCARBONYL-VALINE-TYROSINE-PROLINE-O-BENZYL TRIPEPTIDE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H41N3O7 |
| InChI | InChI=1S/C31H41N3O7/c1-20(2)26(33-30(39)41-31(3,4)5)27(36)32-24(18-21-13-15-23(35)16-14-21)28(37)34-17-9-12-25(34)29(38)40-19-22-10-7-6-8-11-22/h6-8,10-11,13-16,20,24-26,35H,9,12,17-19H2,1-5H3,(H,32,36)(H,33,39)/t24-,25-,26-/m1/s1 |
| InChIKey | XENVEDZHTOIKLW-TWJOJJKGSA-N |
| Instrument Name | Bruker WP-80 |
| Literature Reference | V.I.SVERGUN, M.B.SMIRNOV, A.A.ANTONOV, E.P.KRYSIN, V.P.PANOV, T.KH.NIKITINA(1981) Khim.Farm.Zhurn.(Russ. Lang.): N5, 92-97. |
| NMR Standard | DMSO-D6 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | C2D6SO dimethylsulfo |