| SpectraBase Compound ID | BdfDKS3ANgb |
|---|---|
| InChI | InChI=1S/C34H48N6O8/c1-34(19-41,13-2-14-37-33(35)36)39-30(46)28-17-22-7-12-25(44)18-27(22)40(28)32(48)26(15-20-3-8-23(42)9-4-20)38-31(47)29(45)16-21-5-10-24(43)11-6-21/h3-6,8-11,22,25-29,41-45H,2,7,12-19H2,1H3,(H,38,47)(H,39,46)(H4,35,36,37)/t22-,25+,26-,27-,28-,29-,34-/m1/s1 |
| InChIKey | GUFVIHAWFOJIAQ-DMZFDLMFSA-N |
| Mol Weight | 668.8 g/mol |
| Molecular Formula | C34H48N6O8 |
| Exact Mass | 668.353363 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | aW1E4xAltg |
|---|---|
| Name | HO-D-HPLA-D-TYR-L-CHOI-L-ARGOL(ALPHA-METHYL) |
| Compound Number | 31D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H48N6O8 |
| InChI | InChI=1S/C34H48N6O8/c1-34(19-41,13-2-14-37-33(35)36)39-30(46)28-17-22-7-12-25(44)18-27(22)40(28)32(48)26(15-20-3-8-23(42)9-4-20)38-31(47)29(45)16-21-5-10-24(43)11-6-21/h3-6,8-11,22,25-29,41-45H,2,7,12-19H2,1H3,(H,38,47)(H,39,46)(H4,35,36,37)/t22-,25+,26-,27-,28-,29-,34-/m1/s1 |
| InChIKey | GUFVIHAWFOJIAQ-DMZFDLMFSA-N |
| Literature Reference Author | T.OHSHIMA.V.GNANADESIKAN,T.SHIBUGUCHHI,Y.FUKUTA,T.NEMOTO,M.S HIBASAKI |
| Literature Reference Citation | J.AM.CHEM.SOC.,125,11206(2003) |
| Literature Reference DOI | 10.1021/ja037290e |
| Molecular Weight | 668.791 g/mol |
| Sample ID | 50526 |
| Solvent | CDCl3 |