![Ethyl (2S)-trans-(Z)-1-(tert-Butoxycarbonyl)-5-[(3'-amino(N-benzyloxycarbonyl)-3'-(methoxycarbonyl)-2'-propenyl]prolinate](/api/spectrum/6EfkUwjxFPW/structure.png?h=300&w=458 "Ethyl (2S)-trans-(Z)-1-(tert-Butoxycarbonyl)-5-[(3'-amino(N-benzyloxycarbonyl)-3'-(methoxycarbonyl)-2'-propenyl]prolinate")
| SpectraBase Compound ID | DVkSRNnwF5l |
|---|---|
| InChI | InChI=1S/C25H34N2O8/c1-6-33-22(29)20-15-13-18(27(20)24(31)35-25(2,3)4)12-14-19(21(28)32-5)26-23(30)34-16-17-10-8-7-9-11-17/h7-11,14,18,20H,6,12-13,15-16H2,1-5H3,(H,26,30)/b19-14+/t18-,20+/m1/s1 |
| InChIKey | DVGZJKVEKLGJQP-JBDPPEMKSA-N |
| Mol Weight | 490.6 g/mol |
| Molecular Formula | C25H34N2O8 |
| Exact Mass | 490.231516 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6EfkUwjxFPW |
|---|---|
| Name | Ethyl (2S)-trans-(Z)-1-(tert-Butoxycarbonyl)-5-[(3'-amino(N-benzyloxycarbonyl)-3'-(methoxycarbonyl)-2'-propenyl]prolinate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H34N2O8 |
| InChI | InChI=1S/C25H34N2O8/c1-6-33-22(29)20-15-13-18(27(20)24(31)35-25(2,3)4)12-14-19(21(28)32-5)26-23(30)34-16-17-10-8-7-9-11-17/h7-11,14,18,20H,6,12-13,15-16H2,1-5H3,(H,26,30)/b19-14+/t18-,20+/m1/s1 |
| InChIKey | DVGZJKVEKLGJQP-JBDPPEMKSA-N |
| Molecular Weight | 490.553 g/mol |
| SMILES | N(C(=O)OCc1ccccc1)\C(=C\C[C@]1(N(C(OC(C)(C)C)=O)[C@](C(=O)OCC)(CC1)[H])[H])C(=O)OC |
| SPLASH | splash10-0006-4943000000-a8d11181e1da92be4d61 |
| Source of Spectrum | F-56-4296-20 |
| Wiley ID | 857524 |