| SpectraBase Compound ID | JnfUH0nUt3S |
|---|---|
| InChI | InChI=1S/C36H46N6O6/c1-3-23(2)31-35(47)38-26(20-24-12-6-4-7-13-24)32(44)39-27(21-25-14-8-5-9-15-25)36(48)42-19-11-16-28(42)33(45)37-22-30(43)41-18-10-17-29(41)34(46)40-31/h4-9,12-15,23,26-29,31H,3,10-11,16-22H2,1-2H3,(H,37,45)(H,38,47)(H,39,44)(H,40,46) |
| InChIKey | BGIIBDKAZHSXJX-UHFFFAOYSA-N |
| Mol Weight | 658.8 g/mol |
| Molecular Formula | C36H46N6O6 |
| Exact Mass | 658.347883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Q3cy0cSsjF |
|---|---|
| Name | DIANTHIN-B |
| Compound Number | 2:CYClO-(ISOLEUCYL-PHENYLALANYL- PHENYLALANYL-PROLYL-GLYCYL-PROLYL-) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H46N6O6 |
| InChI | InChI=1S/C36H46N6O6/c1-3-23(2)31-35(47)38-26(20-24-12-6-4-7-13-24)32(44)39-27(21-25-14-8-5-9-15-25)36(48)42-19-11-16-28(42)33(45)37-22-30(43)41-18-10-17-29(41)34(46)40-31/h4-9,12-15,23,26-29,31H,3,10-11,16-22H2,1-2H3,(H,37,45)(H,38,47)(H,39,44)(H,40,46) |
| InChIKey | BGIIBDKAZHSXJX-UHFFFAOYSA-N |
| Literature Reference Author | Y.C.WANG,N.H.TAN,J.ZHOU,H.M.WU |
| Literature Reference Citation | PHYTOCHEM.,49,1453(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00857-1 |
| Molecular Weight | 658.798 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU608 |