| SpectraBase Compound ID | 3RO6DKyGryj |
|---|---|
| InChI | InChI=1S/C42H36ClN2O10PS4.C6H15N/c1-23-24(2)58-39(57-23)40-59-34-35(46)44-41(48)45(37(34)60-40)36-33(54-38(47)29-16-10-11-17-30(29)43)32(55-56(49)50)31(53-36)22-52-42(25-12-6-4-7-13-25,26-14-8-5-9-15-26)27-18-20-28(51-3)21-19-27;1-4-7(5-2)6-3/h4-21,31-33,36,56H,22H2,1-3H3,(H,49,50)(H,44,46,48);4-6H2,1-3H3/t31-,32-,33-,36-;/m1./s1 |
| InChIKey | BQSZBNKUDYEVLT-HOWVCSHNSA-N |
| Mol Weight | 1024.6 g/mol |
| Molecular Formula | C48H51ClN3O10PS4 |
| Exact Mass | 1023.188344 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DKkTh8ZCw8g |
|---|---|
| Name | BQSZBNKUDYEVLT-HOWVCSHNSA-N |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H50ClN3O10PS4 |
| InChI | InChI=1S/C42H36ClN2O10PS4.C6H15N/c1-23-24(2)58-39(57-23)40-59-34-35(46)44-41(48)45(37(34)60-40)36-33(54-38(47)29-16-10-11-17-30(29)43)32(55-56(49)50)31(53-36)22-52-42(25-12-6-4-7-13-25,26-14-8-5-9-15-26)27-18-20-28(51-3)21-19-27;1-4-7(5-2)6-3/h4-21,31-33,36,56H,22H2,1-3H3,(H,49,50)(H,44,46,48);4-6H2,1-3H3/t31-,32-,33-,36-;/m1./s1 |
| InChIKey | BQSZBNKUDYEVLT-HOWVCSHNSA-N |
| Literature Reference Author | O.NEILANDS,V.LIEPINSH,B.TUROVSKA |
| Literature Reference Citation | ORG.LETTERS,1,2065(1999) |
| Literature Reference DOI | 10.1021/ol9910868 |
| Solvent | CDCl3 |
| Source File Reference | UWVN32837 |