![BOC-L-ARG-(TOS)-L-PRO-PHI-[CN4]-L-ALA-OH](/api/spectrum/8olEhE5IF1D/structure.png?h=300&w=458 "BOC-L-ARG-(TOS)-L-PRO-PHI-[CN4]-L-ALA-OH")
| SpectraBase Compound ID | EPgVE7iSBLX |
|---|---|
| InChI | InChI=1S/C26H39N9O7S/c1-16-10-12-18(13-11-16)43(40,41)31-24(27)28-14-6-8-19(29-25(39)42-26(3,4)5)22(36)34-15-7-9-20(34)21-30-32-33-35(21)17(2)23(37)38/h10-13,17,19-20H,6-9,14-15H2,1-5H3,(H,29,39)(H,37,38)(H3,27,28,31)/t17?,19-,20?/m0/s1 |
| InChIKey | ZGINVSDHLWTLPR-SYYJFZTOSA-N |
| Mol Weight | 621.7 g/mol |
| Molecular Formula | C26H39N9O7S |
| Exact Mass | 621.269316 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8olEhE5IF1D |
|---|---|
| Name | BOC-L-ARG-(TOS)-L-PRO-PHI-[CN4]-L-ALA-OH |
| CAS Registry Number | 137234-23-2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H39N9O7S |
| InChI | InChI=1S/C26H39N9O7S/c1-16-10-12-18(13-11-16)43(40,41)31-24(27)28-14-6-8-19(29-25(39)42-26(3,4)5)22(36)34-15-7-9-20(34)21-30-32-33-35(21)17(2)23(37)38/h10-13,17,19-20H,6-9,14-15H2,1-5H3,(H,29,39)(H,37,38)(H3,27,28,31)/t17?,19-,20?/m0/s1 |
| InChIKey | ZGINVSDHLWTLPR-SYYJFZTOSA-N |
| Literature Reference Author | J.ZABROCKI,J.B.DUNBAR,K.W.MARSHALL,M.V.TOTH,G.R.MARSHALL |
| Literature Reference Citation | J.ORG.CHEM.,57,202(1992) |
| Literature Reference DOI | 10.1021/jo00027a038 |
| Molecular Weight | 621.712 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS1687 |