| SpectraBase Compound ID | 9Tnc0YOvNpE |
|---|---|
| InChI | InChI=1S/C52H66N9O13PS/c1-32(2)61(33(3)4)75(71-25-13-24-53)74-42-27-46(60-30-35(6)48(63)57-51(60)65)72-43(42)28-54-49(58-76(9,66)67)55-41-26-45(59-29-34(5)47(62)56-50(59)64)73-44(41)31-70-52(36-14-11-10-12-15-36,37-16-20-39(68-7)21-17-37)38-18-22-40(69-8)23-19-38/h10-12,14-23,29-30,32-33,41-46H,13,25-28,31H2,1-9H3,(H2,54,55,58)(H,56,62,64)(H,57,63,65)/t41-,42-,43+,44+,45+,46+,75?/m1/s1 |
| InChIKey | YEKIWQDJPPHJQC-LSCOUJAMSA-N |
| Mol Weight | 1088.2 g/mol |
| Molecular Formula | C52H66N9O13PS |
| Exact Mass | 1087.423841 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1TGY6LRUzxw |
|---|---|
| Name | ISOMER-#2 |
| Compound Number | 7A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H66N9O13PS |
| InChI | InChI=1S/C52H66N9O13PS/c1-32(2)61(33(3)4)75(71-25-13-24-53)74-42-27-46(60-30-35(6)48(63)57-51(60)65)72-43(42)28-54-49(58-76(9,66)67)55-41-26-45(59-29-34(5)47(62)56-50(59)64)73-44(41)31-70-52(36-14-11-10-12-15-36,37-16-20-39(68-7)21-17-37)38-18-22-40(69-8)23-19-38/h10-12,14-23,29-30,32-33,41-46H,13,25-28,31H2,1-9H3,(H2,54,55,58)(H,56,62,64)(H,57,63,65)/t41-,42-,43+,44+,45+,46+,75?/m1/s1 |
| InChIKey | YEKIWQDJPPHJQC-LSCOUJAMSA-N |
| Literature Reference Author | F.VANDENDRIESSCHE,A.VANAERSCHOT,M.VOORTMANS,G.JANSSEN,R.BUSS ON,A.VANOVERBEKE,W.V |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,1567(1993) |
| Literature Reference DOI | 10.1039/p19930001567 |
| Solvent | CDCl3 |
| Source File Reference | UWCS24063 |