![#21;(R)-2-[1-[(R)-2-[(1-((R)-2-(1-N-TERT.-BUTOXYCARBONYL-AMINO)-ETHYL-5-METHYLOXAZOLE-4-CARBONYL)-AMINO]-ISOBUTYLTHIAZOLE-4-CARBONYL]-AMINO]-ETHYLTHIAZOLE-4-CA](/api/spectrum/HB9QiTOMnxF/structure.png?h=300&w=458 "#21;(R)-2-[1-[(R)-2-[(1-((R)-2-(1-N-TERT.-BUTOXYCARBONYL-AMINO)-ETHYL-5-METHYLOXAZOLE-4-CARBONYL)-AMINO]-ISOBUTYLTHIAZOLE-4-CARBONYL]-AMINO]-ETHYLTHIAZOLE-4-CA")
| SpectraBase Compound ID | C20HVN8Z4F4 |
|---|---|
| InChI | InChI=1S/C26H34N6O7S2/c1-11(2)17(23-29-15(9-41-23)19(33)27-13(4)22-30-16(10-40-22)24(35)36)31-20(34)18-14(5)38-21(32-18)12(3)28-25(37)39-26(6,7)8/h9-13,17H,1-8H3,(H,27,33)(H,28,37)(H,31,34)(H,35,36)/t12-,13+,17+/m0/s1 |
| InChIKey | CISALVDPWLIUAG-OGHNNQOOSA-N |
| Mol Weight | 606.7 g/mol |
| Molecular Formula | C26H34N6O7S2 |
| Exact Mass | 606.19304 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HB9QiTOMnxF |
|---|---|
| Name | #21;(R)-2-[1-[(R)-2-[(1-((R)-2-(1-N-TERT.-BUTOXYCARBONYL-AMINO)-ETHYL-5-METHYLOXAZOLE-4-CARBONYL)-AMINO]-ISOBUTYLTHIAZOLE-4-CARBONYL]-AMINO]-ETHYLTHIAZOLE-4-CA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H34N6O7S2 |
| InChI | InChI=1S/C26H34N6O7S2/c1-11(2)17(23-29-15(9-41-23)19(33)27-13(4)22-30-16(10-40-22)24(35)36)31-20(34)18-14(5)38-21(32-18)12(3)28-25(37)39-26(6,7)8/h9-13,17H,1-8H3,(H,27,33)(H,28,37)(H,31,34)(H,35,36)/t12-,13+,17+/m0/s1 |
| InChIKey | CISALVDPWLIUAG-OGHNNQOOSA-N |
| Literature Reference Author | Z.XIA,C.D.SMITH |
| Literature Reference Citation | J.ORG.CHEM.,66,3459(2001) |
| Literature Reference DOI | 10.1021/jo005783l |
| Molecular Weight | 606.712 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS26922 |