| SpectraBase Compound ID | 4DKy2j8UjeT |
|---|---|
| InChI | InChI=1S/C37H49N7O8/c1-22(2)17-26-34(49)43-29(21-45)35(50)41-27(18-24-11-6-4-7-12-24)33(48)39-23(3)32(47)42-28(19-25-13-8-5-9-14-25)37(52)44-16-10-15-30(44)36(51)38-20-31(46)40-26/h4-9,11-14,22-23,26-30,45H,10,15-21H2,1-3H3,(H,38,51)(H,39,48)(H,40,46)(H,41,50)(H,42,47)(H,43,49) |
| InChIKey | VYIVDIARTLHCNH-UHFFFAOYSA-N |
| Mol Weight | 719.8 g/mol |
| Molecular Formula | C37H49N7O8 |
| Exact Mass | 719.364262 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5qfPVggrxp0 |
|---|---|
| Name | SEGETALIN-D;CYCLO-(-GLY-LEU-SER-PHE-ALA-PHE-PRO-) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H49N7O8 |
| InChI | InChI=1S/C37H49N7O8/c1-22(2)17-26-34(49)43-29(21-45)35(50)41-27(18-24-11-6-4-7-12-24)33(48)39-23(3)32(47)42-28(19-25-13-8-5-9-14-25)37(52)44-16-10-15-30(44)36(51)38-20-31(46)40-26/h4-9,11-14,22-23,26-30,45H,10,15-21H2,1-3H3,(H,38,51)(H,39,48)(H,40,46)(H,41,50)(H,42,47)(H,43,49) |
| InChIKey | VYIVDIARTLHCNH-UHFFFAOYSA-N |
| Literature Reference Author | H.MORITA,Y.S.YUN,K.TAKEYA,H.ITOKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,45,883(1997) |
| Literature Reference DOI | 10.1248/cpb.45.883 |
| Molecular Weight | 719.838 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN28840 |