| SpectraBase Compound ID | 3r7BDFOjYFJ |
|---|---|
| InChI | InChI=1S/C45H39N5O8/c1-54-34-22-18-32(19-23-34)45(31-16-10-5-11-17-31,33-20-24-35(55-2)25-21-33)58-36-26-56-43(38(51)39(36)57-44(53)30-14-8-4-9-15-30)50-28-48-37-40(46-27-47-41(37)50)49-42(52)29-12-6-3-7-13-29/h3-25,27-28,36,38-39,43,51H,26H2,1-2H3,(H,46,47,49,52)/t36-,38-,39-,43-/m0/s1 |
| InChIKey | TYTVHRFZZZECRJ-DICNLNQGSA-N |
| Mol Weight | 777.8 g/mol |
| Molecular Formula | C45H39N5O8 |
| Exact Mass | 777.279863 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 62ue07eRvcH |
|---|---|
| Name | TYTVHRFZZZECRJ-DICNLNQGSA-N |
| Compound Number | 1731 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H39N5O8 |
| InChI | InChI=1S/C45H39N5O8/c1-54-34-22-18-32(19-23-34)45(31-16-10-5-11-17-31,33-20-24-35(55-2)25-21-33)58-36-26-56-43(38(51)39(36)57-44(53)30-14-8-4-9-15-30)50-28-48-37-40(46-27-47-41(37)50)49-42(52)29-12-6-3-7-13-29/h3-25,27-28,36,38-39,43,51H,26H2,1-2H3,(H,46,47,49,52)/t36-,38-,39-,43-/m0/s1 |
| InChIKey | TYTVHRFZZZECRJ-DICNLNQGSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Molecular Weight | 777.833 g/mol |
| Sample ID | 2399 |
| Solvent | CDCl3 |