| SpectraBase Compound ID | 9N5MrHIJch4 |
|---|---|
| InChI | InChI=1S/C39H58N8O9/c1-6-21(3)31-37(54)42-26(16-17-30(40)49)34(51)45-32(22(4)7-2)39(56)47-19-9-11-29(47)36(53)43-27(20-24-12-14-25(48)15-13-24)38(55)46-18-8-10-28(46)35(52)41-23(5)33(50)44-31/h12-15,21-23,26-29,31-32,48H,6-11,16-20H2,1-5H3,(H2,40,49)(H,41,52)(H,42,54)(H,43,53)(H,44,50)(H,45,51)/t21?,22?,23-,26-,27-,28-,29-,31-,32-/m0/s1 |
| InChIKey | ABLJJFBJJTYMSL-FOJMEVIISA-N |
| Mol Weight | 782.9 g/mol |
| Molecular Formula | C39H58N8O9 |
| Exact Mass | 782.432675 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8kY6tLzWEhV |
|---|---|
| Name | STYLISSMIDE_E;CYCLO-(CIS-PRO-(1)-TYR-(2)-TRANS-PRO-(3)-ALA-(4)-ILE-(5)-GLN-(6)-ILE-(7)) |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H58N8O9 |
| InChI | InChI=1S/C39H58N8O9/c1-6-21(3)31-37(54)42-26(16-17-30(40)49)34(51)45-32(22(4)7-2)39(56)47-19-9-11-29(47)36(53)43-27(20-24-12-14-25(48)15-13-24)38(55)46-18-8-10-28(46)35(52)41-23(5)33(50)44-31/h12-15,21-23,26-29,31-32,48H,6-11,16-20H2,1-5H3,(H2,40,49)(H,41,52)(H,42,54)(H,43,53)(H,44,50)(H,45,51)/t21?,22?,23-,26-,27-,28-,29-,31-,32-/m0/s1 |
| InChIKey | ABLJJFBJJTYMSL-FOJMEVIISA-N |
| Literature Reference Author | C.CYCHON,M.KOECK |
| Literature Reference Citation | J.NAT.PROD.,73,738(2010) |
| Literature Reference DOI | 10.1021/np900664f |
| Molecular Weight | 782.938 g/mol |
| Sample ID | 35378 |
| Solvent | DMSO-D6 |