| SpectraBase Compound ID | BWKg000VZK7 |
|---|---|
| InChI | InChI=1S/C40H40N5O8PS.Na/c1-48-31-18-14-29(15-19-31)40(28-12-8-5-9-13-28,30-16-20-32(49-2)21-17-30)51-24-34-33(53-54(3,47)55)22-35(52-34)45-26-43-36-37(41-25-42-38(36)45)44-39(46)50-23-27-10-6-4-7-11-27;/h4-21,25-26,33-35H,22-24H2,1-3H3,(H,47,55)(H,41,42,44,46);/q;+1/p-1/t33-,34+,35+,54?;/m1./s1 |
| InChIKey | IKFSVBVQMFXPJB-CRGCAULRSA-M |
| Mol Weight | 803.8 g/mol |
| Molecular Formula | C40H39N5NaO8PS |
| Exact Mass | 803.215466 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2NcFUKOqlvS |
|---|---|
| Name | IKFSVBVQMFXPJB-CRGCAULRSA-M |
| Compound Number | SLOW_RP-6-(B=A_BZ)-SODIUM_SALT |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H39N5NaO8PS |
| InChI | InChI=1S/C40H40N5O8PS.Na/c1-48-31-18-14-29(15-19-31)40(28-12-8-5-9-13-28,30-16-20-32(49-2)21-17-30)51-24-34-33(53-54(3,47)55)22-35(52-34)45-26-43-36-37(41-25-42-38(36)45)44-39(46)50-23-27-10-6-4-7-11-27;/h4-21,25-26,33-35H,22-24H2,1-3H3,(H,47,55)(H,41,42,44,46);/q;+1/p-1/t33-,34+,35+,54?;/m1./s1 |
| InChIKey | IKFSVBVQMFXPJB-CRGCAULRSA-M |
| Literature Reference Author | L.A.WOZNIAK,A.CHWOROS,J.PYZOWSKI,W.J.STEC |
| Literature Reference Citation | J.ORG.CHEM.,63,9109(1998) |
| Literature Reference DOI | 10.1021/jo981304v |
| Solvent | DMF:C6D6 |
| Source File Reference | UWMZ27157 |