| SpectraBase Compound ID | 1WB54Z1wkzv |
|---|---|
| InChI | InChI=1S/C39H69NO6SSi2/c1-13-14-18-23-31(45-48(9,10)37(2,3)4)27-28-33-34(46-49(11,12)38(5,6)7)30-35(40-8)39(33,29-22-16-15-21-26-36(41)42)47(43,44)32-24-19-17-20-25-32/h16-17,19-20,22,24-25,27-28,31,33-35,40H,13-15,18,21,23,26,29-30H2,1-12H3,(H,41,42)/b22-16+,28-27+ |
| InChIKey | MCZNFJXMODMPMQ-DVLQTGRYSA-N |
| Mol Weight | 736.2 g/mol |
| Molecular Formula | C39H69NO6SSi2 |
| Exact Mass | 735.438413 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B0GbLJG9FG |
|---|---|
| Name | (5Z,13E,8R,9S,11R,12S,15S)-11,15-Bis-(tert.-butyldimethylsiloxy)-9-(methylamino)-8-(phenylsulfonyl)-5,13-prostadienoic-A |
| CAS Registry Number | 77494-48-5 |
| Comments | reassigned |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C39H69NO6SSi2 |
| InChI | InChI=1S/C39H69NO6SSi2/c1-13-14-18-23-31(45-48(9,10)37(2,3)4)27-28-33-34(46-49(11,12)38(5,6)7)30-35(40-8)39(33,29-22-16-15-21-26-36(41)42)47(43,44)32-24-19-17-20-25-32/h16-17,19-20,22,24-25,27-28,31,33-35,40H,13-15,18,21,23,26,29-30H2,1-12H3,(H,41,42)/b22-16+,28-27+ |
| InChIKey | MCZNFJXMODMPMQ-DVLQTGRYSA-N |
| Instrument Name | SF = 080 MHz |
| Literature Reference | J. Org. Chem. 48, 2167 (1983). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |