| SpectraBase Compound ID | 8oLfM5AorPs |
|---|---|
| InChI | InChI=1S/C45H58N6O12/c1-45(2,3)63-44(59)51-34(23-25-39(54)60-28-31-15-7-4-8-16-31)40(55)48-27-38(53)49-35(22-24-37(46)52)41(56)50-36(42(57)61-29-32-17-9-5-10-18-32)21-13-14-26-47-43(58)62-30-33-19-11-6-12-20-33/h4-12,15-20,34-36H,13-14,21-30H2,1-3H3,(H2,46,52)(H,47,58)(H,48,55)(H,49,53)(H,50,56)(H,51,59)/t34-,35+,36+/m1/s1 |
| InChIKey | DBGUXDKIAHGFJG-SBPNQFBHSA-N |
| Mol Weight | 875.0 g/mol |
| Molecular Formula | C45H58N6O12 |
| Exact Mass | 874.411271 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LfGcxqE1YLS |
|---|---|
| Name | TERT.-BUTOXYCARBONYL-GAMMA-BENZYL-L-GLUTAMYLGLYCYL-L-GLUTAMINYL-N-(EPSILON)-BENZOYLOXYCARBONYL-L-LYSINE-BENZYLESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H58N6O12 |
| InChI | InChI=1S/C45H58N6O12/c1-45(2,3)63-44(59)51-34(23-25-39(54)60-28-31-15-7-4-8-16-31)40(55)48-27-38(53)49-35(22-24-37(46)52)41(56)50-36(42(57)61-29-32-17-9-5-10-18-32)21-13-14-26-47-43(58)62-30-33-19-11-6-12-20-33/h4-12,15-20,34-36H,13-14,21-30H2,1-3H3,(H2,46,52)(H,47,58)(H,48,55)(H,49,53)(H,50,56)(H,51,59)/t34-,35+,36+/m1/s1 |
| InChIKey | DBGUXDKIAHGFJG-SBPNQFBHSA-N |
| Literature Reference Author | S.J.PASARIBU |
| Literature Reference Citation | AUSTR.J.CHEM.,30,2533(1977) |
| Literature Reference DOI | 10.1071/ch9772533 |
| Molecular Weight | 874.989 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS6202 |