![Cyclo[Ala-Pro-Phe-Ser-Thr(rprenyl)-Ser(rprenyl)-Iie]](/api/spectrum/7cAQnELoe4j/structure.png?h=300&w=458 "Cyclo[Ala-Pro-Phe-Ser-Thr(rprenyl)-Ser(rprenyl)-Iie]")
| SpectraBase Compound ID | K3vFo2WZIH8 |
|---|---|
| InChI | InChI=1S/C43H65N7O10/c1-9-27(6)35-41(56)44-28(7)43(58)50-19-13-16-34(50)40(55)45-31(22-30-14-11-10-12-15-30)37(52)46-32(23-51)38(53)49-36(29(8)60-21-18-26(4)5)42(57)47-33(39(54)48-35)24-59-20-17-25(2)3/h10-12,14-15,17-18,27-29,31-36,51H,9,13,16,19-24H2,1-8H3,(H,44,56)(H,45,55)(H,46,52)(H,47,57)(H,48,54)(H,49,53) |
| InChIKey | YNKKZMGASKBTPU-UHFFFAOYSA-N |
| Mol Weight | 840.0 g/mol |
| Molecular Formula | C43H65N7O10 |
| Exact Mass | 839.479291 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7cAQnELoe4j |
|---|---|
| Name | Cyclo[Ala-Pro-Phe-Ser-Thr(rprenyl)-Ser(rprenyl)-Iie] |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C43H65N7O10 |
| InChI | InChI=1S/C43H65N7O10/c1-9-27(6)35-41(56)44-28(7)43(58)50-19-13-16-34(50)40(55)45-31(22-30-14-11-10-12-15-30)37(52)46-32(23-51)38(53)49-36(29(8)60-21-18-26(4)5)42(57)47-33(39(54)48-35)24-59-20-17-25(2)3/h10-12,14-15,17-18,27-29,31-36,51H,9,13,16,19-24H2,1-8H3,(H,44,56)(H,45,55)(H,46,52)(H,47,57)(H,48,54)(H,49,53) |
| InChIKey | YNKKZMGASKBTPU-UHFFFAOYSA-N |
| Molecular Weight | 840.032 g/mol |
| SMILES | N1C(C(N2C(C(NC(C(NC(CO)C(NC(C(OCC=C(C)C)C)C(NC(C(NC(C1=O)C(CC)C)=O)COCC=C(C)C)=O)=O)=O)Cc1ccccc1)=O)CCC2)=O)C |
| SPLASH | splash10-0fi0-0000000960-4f9f951d2d09fe0da270 |
| Source of Spectrum | J-65-1044-27 |
| Wiley ID | 1532129 |