| SpectraBase Compound ID | 6cOGg9h5xus |
|---|---|
| InChI | InChI=1S/C48H63N7O13/c1-32(52-47(64)68-48(2,3)4)42(59)54-36(24-26-41(58)65-29-33-16-8-5-9-17-33)43(60)51-28-40(57)53-37(23-25-39(49)56)44(61)55-38(45(62)66-30-34-18-10-6-11-19-34)22-14-15-27-50-46(63)67-31-35-20-12-7-13-21-35/h5-13,16-21,32,36-38H,14-15,22-31H2,1-4H3,(H2,49,56)(H,50,63)(H,51,60)(H,52,64)(H,53,57)(H,54,59)(H,55,61)/t32-,36-,37-,38-/m0/s1 |
| InChIKey | INGFHECPUASJMR-KBJONWADSA-N |
| Mol Weight | 946.1 g/mol |
| Molecular Formula | C48H63N7O13 |
| Exact Mass | 945.448385 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gk4ndrv7kGI |
|---|---|
| Name | TERT.-BUTOXYCARBONYL-L-ALANYL-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 | C48H63N7O13 |
| InChI | InChI=1S/C48H63N7O13/c1-32(52-47(64)68-48(2,3)4)42(59)54-36(24-26-41(58)65-29-33-16-8-5-9-17-33)43(60)51-28-40(57)53-37(23-25-39(49)56)44(61)55-38(45(62)66-30-34-18-10-6-11-19-34)22-14-15-27-50-46(63)67-31-35-20-12-7-13-21-35/h5-13,16-21,32,36-38H,14-15,22-31H2,1-4H3,(H2,49,56)(H,50,63)(H,51,60)(H,52,64)(H,53,57)(H,54,59)(H,55,61)/t32-,36-,37-,38-/m0/s1 |
| InChIKey | INGFHECPUASJMR-KBJONWADSA-N |
| Literature Reference Author | S.J.PASARIBU |
| Literature Reference Citation | AUSTR.J.CHEM.,30,2533(1977) |
| Literature Reference DOI | 10.1071/ch9772533 |
| Molecular Weight | 946.067 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS6203 |