| SpectraBase Compound ID | 7EAqgjn41F4 |
|---|---|
| InChI | InChI=1S/C22H26N2O7S/c1-20(29,12-25)17(26)22-19(28)23-21(30,18(27)24-22)15(8-9-31-22)11-32-16-7-6-13-4-2-3-5-14(13)10-16/h2-7,10,15,17,25-26,29-30H,8-9,11-12H2,1H3,(H,23,28)(H,24,27)/t15-,17?,20?,21-,22-/m1/s1 |
| InChIKey | XVLGRAKNMYAVKQ-CJAPCRCDSA-N |
| Mol Weight | 462.52 g/mol |
| Molecular Formula | C22H26N2O7S |
| Exact Mass | 462.146072 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DaJj4lsOpW8 |
|---|---|
| Name | 5A-(NAPHTH-2-YL-SULFANYL)-DIHYDROBICYCLOMYCIN;MAJOR-DIASTEREOMER |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H26N2O7S |
| InChI | InChI=1S/C22H26N2O7S/c1-20(29,12-25)17(26)22-19(28)23-21(30,18(27)24-22)15(8-9-31-22)11-32-16-7-6-13-4-2-3-5-14(13)10-16/h2-7,10,15,17,25-26,29-30H,8-9,11-12H2,1H3,(H,23,28)(H,24,27)/t15-,17?,20?,21-,22-/m1/s1 |
| InChIKey | XVLGRAKNMYAVKQ-CJAPCRCDSA-N |
| Literature Reference Author | A.P.BROGAN,W.R.WIDGER,H.KOHN |
| Literature Reference Citation | J.ORG.CHEM.,68,5575(2003) |
| Literature Reference DOI | 10.1021/jo030020u |
| Molecular Weight | 462.518 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN25368 |