| SpectraBase Compound ID | 2qDzb8EOALj |
|---|---|
| InChI | InChI=1S/C31H51N5O6/c1-19(2)15-24(32-21(5)38)26(39)35-31(8,9)29(42)34-25(16-20(3)4)27(40)36-30(6,7)28(41)33-23(18-37)17-22-13-11-10-12-14-22/h10-14,19-20,23-25,37H,15-18H2,1-9H3,(H,32,38)(H,33,41)(H,34,42)(H,35,39)(H,36,40)/t23-,24-,25-/m0/s1 |
| InChIKey | KYTOQCVRVYQYDN-SDHOMARFSA-N |
| Mol Weight | 589.8 g/mol |
| Molecular Formula | C31H51N5O6 |
| Exact Mass | 589.383934 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HJ1KDx7BBgk |
|---|---|
| Name | PEPTAIBOLIN;AC-L-LEU-AIB-L-LEU-AIB-L-PHEOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H51N5O6 |
| InChI | InChI=1S/C31H51N5O6/c1-19(2)15-24(32-21(5)38)26(39)35-31(8,9)29(42)34-25(16-20(3)4)27(40)36-30(6,7)28(41)33-23(18-37)17-22-13-11-10-12-14-22/h10-14,19-20,23-25,37H,15-18H2,1-9H3,(H,32,38)(H,33,41)(H,34,42)(H,35,39)(H,36,40)/t23-,24-,25-/m0/s1 |
| InChIKey | KYTOQCVRVYQYDN-SDHOMARFSA-N |
| Literature Reference Author | H.HUELSMANN,S.HEINZE,M.RITZAU,B.SCHLEGEL,U.GRAEFE |
| Literature Reference Citation | J.ANTIBIOTICS,51,1055(1998) |
| Literature Reference DOI | 10.7164/antibiotics.51.1055 |
| Molecular Weight | 589.776 g/mol |
| Solvent | DMSO |
| Source File Reference | UWKP668 |