| SpectraBase Compound ID | 1e6mPhbzg58 |
|---|---|
| InChI | InChI=1S/C38H44N5O9PS/c1-24(2)21-49-37(45)42-36-40-34-33(35(44)41-36)39-23-43(34)32-20-30(52-53(5,46)54-6)31(51-32)22-50-38(25-10-8-7-9-11-25,26-12-16-28(47-3)17-13-26)27-14-18-29(48-4)19-15-27/h7-19,23-24,30-32H,20-22H2,1-6H3,(H2,40,41,42,44,45)/t30-,31+,32+,53?/m1/s1 |
| InChIKey | QGJXVVTVUAJFFT-MFPMASKKSA-N |
| Mol Weight | 777.8 g/mol |
| Molecular Formula | C38H44N5O9PS |
| Exact Mass | 777.259736 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I83DVtIDdQ6 |
|---|---|
| Name | R=CH3) |
| Compound Number | SLOW_RP-3-(B=G_IBU |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H44N5O9PS |
| InChI | InChI=1S/C38H44N5O9PS/c1-24(2)21-49-37(45)42-36-40-34-33(35(44)41-36)39-23-43(34)32-20-30(52-53(5,46)54-6)31(51-32)22-50-38(25-10-8-7-9-11-25,26-12-16-28(47-3)17-13-26)27-14-18-29(48-4)19-15-27/h7-19,23-24,30-32H,20-22H2,1-6H3,(H2,40,41,42,44,45)/t30-,31+,32+,53?/m1/s1 |
| InChIKey | QGJXVVTVUAJFFT-MFPMASKKSA-N |
| 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 | Unknown |
| Source File Reference | UWMZ27168 |