| SpectraBase Compound ID | Ipts1sS2zfm |
|---|---|
| InChI | InChI=1S/C28H42N4O7S/c1-18(2)17-23-26(34)29-22(28(36)39-6)9-7-8-15-32(40(37,38)21-12-10-20(5)11-13-21)16-14-24(33)31-25(19(3)4)27(35)30-23/h7-8,10-13,18-19,22-23,25H,9,14-17H2,1-6H3,(H,29,34)(H,30,35)(H,31,33)/b8-7+/t22-,23+,25+/m1/s1 |
| InChIKey | BVZVVGRMQBJFCL-PBSSTCTISA-N |
| Mol Weight | 578.7 g/mol |
| Molecular Formula | C28H42N4O7S |
| Exact Mass | 578.277421 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1N5T3EjYLTb |
|---|---|
| Name | BVZVVGRMQBJFCL-PBSSTCTISA-N |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42N4O7S |
| InChI | InChI=1S/C28H42N4O7S/c1-18(2)17-23-26(34)29-22(28(36)39-6)9-7-8-15-32(40(37,38)21-12-10-20(5)11-13-21)16-14-24(33)31-25(19(3)4)27(35)30-23/h7-8,10-13,18-19,22-23,25H,9,14-17H2,1-6H3,(H,29,34)(H,30,35)(H,31,33)/b8-7+/t22-,23+,25+/m1/s1 |
| InChIKey | BVZVVGRMQBJFCL-PBSSTCTISA-N |
| Literature Reference Author | U.KAZMAIER,S.MAIER |
| Literature Reference Citation | ORG.LETTERS,1,1763(1999) |
| Literature Reference DOI | 10.1021/ol9910262 |
| Molecular Weight | 578.724 g/mol |
| Sample ID | 32922 |
| Solvent | DMFA |