| SpectraBase Compound ID | 9TJaAGgSEMV |
|---|---|
| InChI | InChI=1S/C30H44N6O6/c1-6-18(4)25-30(42)34-24(17(2)3)29(41)33-21(15-20-11-8-7-9-12-20)27(39)32-19(5)26(38)31-16-23(37)36-14-10-13-22(36)28(40)35-25/h7-9,11-12,17-19,21-22,24-25H,6,10,13-16H2,1-5H3,(H,31,38)(H,32,39)(H,33,41)(H,34,42)(H,35,40) |
| InChIKey | PAPASISLWQPNNI-UHFFFAOYSA-N |
| Mol Weight | 584.7 g/mol |
| Molecular Formula | C30H44N6O6 |
| Exact Mass | 584.332233 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5nNGoan8soK |
|---|---|
| Name | CLEROMYRINE I(CYCLOHEXAPEPTIDE-ALA-GLY-PRO-ILE-VAL-PHE) |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C30H44N6O6/c1-6-18(4)25-30(42)34-24(17(2)3)29(41)33-21(15-20-11-8-7-9-12-20)27(39)32-19(5)26(38)31-16-23(37)36-14-10-13-22(36)28(40)35-25/h7-9,11-12,17-19,21-22,24-25H,6,10,13-16H2,1-5H3,(H,31,38)(H,32,39)(H,33,41)(H,34,42)(H,35,40) |
| InChIKey | PAPASISLWQPNNI-UHFFFAOYSA-N |
| Literature Reference | H.A.M PEPERMANS TETRAHEDRON,45,5845(1989) |
| Solvent | Deuterium oxide |