| SpectraBase Compound ID | 87f4p1BweN5 |
|---|---|
| InChI | InChI=1S/C23H31N3O6/c1-13(2)19-22(29)26-18(8-6-7-16-9-11-17(31-5)12-10-16)21(28)24-14(3)20(27)25-15(4)23(30)32-19/h9-13,15,18-19H,3,6-8H2,1-2,4-5H3,(H,24,28)(H,25,27)(H,26,29) |
| InChIKey | SYONRRYXABHFOE-UHFFFAOYSA-N |
| Mol Weight | 445.52 g/mol |
| Molecular Formula | C23H31N3O6 |
| Exact Mass | 445.221286 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | EBGCaWrzbnE |
|---|---|
| Name | Am toxin I |
| Alternate Name(s) | Cyclo(2,3-didehydroalanyl-L-alanyl-(2S)-2-hydroxy-3-methylbutanoyl-5-(4-methoxyphenyl)-L-norvalyl) |
| CAS Registry Number | 53193-10-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H31N3O6 |
| InChI | InChI=1S/C23H31N3O6/c1-13(2)19-22(29)26-18(8-6-7-16-9-11-17(31-5)12-10-16)21(28)24-14(3)20(27)25-15(4)23(30)32-19/h9-13,15,18-19H,3,6-8H2,1-2,4-5H3,(H,24,28)(H,25,27)(H,26,29) |
| InChIKey | SYONRRYXABHFOE-UHFFFAOYSA-N |
| Molecular Weight | 445.516 g/mol |
| SMILES | N1C(C(NC(=C)C(NC(C(OC(C1=O)C(C)C)=O)C)=O)=O)CCCc1ccc(cc1)OC |
| SPLASH | splash10-01qd-1911100000-b1cfb311acda9b311861 |
| Source of Spectrum | KO-4-140-5 |
| Wiley ID | 1386348 |