| SpectraBase Compound ID | KpjErwn296A |
|---|---|
| InChI | InChI=1S/C45H53N4O13P/c1-45(2,3)60-44(55)49-38(31-59-63(56,61-34-21-13-7-14-22-34)62-35-23-15-8-16-24-35)43(54)48-37(26-28-40(51)58-30-33-19-11-6-12-20-33)42(53)47-36(41(52)46-4)25-27-39(50)57-29-32-17-9-5-10-18-32/h5-24,36-38H,25-31H2,1-4H3,(H,46,52)(H,47,53)(H,48,54)(H,49,55)/t36-,37-,38-/m0/s1 |
| InChIKey | HSTUQBAASQCBIG-QXUSSCGESA-N |
| Mol Weight | 888.9 g/mol |
| Molecular Formula | C45H53N4O13P |
| Exact Mass | 888.334675 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5tmyL9NdT1E |
|---|---|
| Name | BOC-SER-(PO3PH2)-GLU-(OBZL)-GLU-(OBZL)-NHME |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H53N4O13P |
| InChI | InChI=1S/C45H53N4O13P/c1-45(2,3)60-44(55)49-38(31-59-63(56,61-34-21-13-7-14-22-34)62-35-23-15-8-16-24-35)43(54)48-37(26-28-40(51)58-30-33-19-11-6-12-20-33)42(53)47-36(41(52)46-4)25-27-39(50)57-29-32-17-9-5-10-18-32/h5-24,36-38H,25-31H2,1-4H3,(H,46,52)(H,47,53)(H,48,54)(H,49,55)/t36-,37-,38-/m0/s1 |
| InChIKey | HSTUQBAASQCBIG-QXUSSCGESA-N |
| Literature Reference Author | J.W.PERICH,R.B.JOHNS,E.C.REYNOLDS |
| Literature Reference Citation | AUSTR.J.CHEM.,45,385(1992) |
| Literature Reference DOI | 10.1071/ch9920385 |
| Solvent | CDCl3 |
| Source File Reference | UWCS21190 |