| SpectraBase Compound ID | Achd3n4Smqc |
|---|---|
| InChI | InChI=1S/2C41H47N6O8P/c2*1-3-55-56(53,27-43-39(48)28(2)44-41(50)54-26-37-35-16-9-7-14-33(35)34-15-8-10-17-36(34)37)46-23-11-18-38(46)40(49)45-31(24-29-12-5-4-6-13-29)25-42-30-19-21-32(22-20-30)47(51)52/h2*4-10,12-17,19-22,28,31,37-38,42H,3,11,18,23-27H2,1-2H3,(H,43,48)(H,44,50)(H,45,49)/t2*28-,31-,38-,56?/m00/s1 |
| InChIKey | JDXQMUXBJHVWJX-XERJPIHKSA-N |
| Mol Weight | 1565.7 g/mol |
| Molecular Formula | C82H94N12O16P2 |
| Exact Mass | 1564.638599 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7vlxHXsF3nF |
|---|---|
| Name | FMOC-ALA-GLY-OMEGA-(PO2ET-N)PRO-PHE-OMEGA-(CH2-N)-PNA |
| Compound Number | 6B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C82H94N12O16P2 |
| InChI | InChI=1S/2C41H47N6O8P/c2*1-3-55-56(53,27-43-39(48)28(2)44-41(50)54-26-37-35-16-9-7-14-33(35)34-15-8-10-17-36(34)37)46-23-11-18-38(46)40(49)45-31(24-29-12-5-4-6-13-29)25-42-30-19-21-32(22-20-30)47(51)52/h2*4-10,12-17,19-22,28,31,37-38,42H,3,11,18,23-27H2,1-2H3,(H,43,48)(H,44,50)(H,45,49)/t2*28-,31-,38-,56?/m00/s1 |
| InChIKey | JDXQMUXBJHVWJX-XERJPIHKSA-N |
| Literature Reference Author | L.DEMANGE,M.MOUTIEZ,C.DUGAVE |
| Literature Reference Citation | J.MED.CHEM.,45,3928(2002) |
| Literature Reference DOI | 10.1021/jm020865i |
| Solvent | CDCl3 |
| Source File Reference | UWLU64815 |