| SpectraBase Compound ID | 15jjPbdbRT5 |
|---|---|
| InChI | InChI=1S/C47H75N3O6/c1-32(13-18-37-34(3)15-20-39-44(37,5)25-11-27-46(39,7)42(52)54-9)23-29-50-31-36(48-49-50)17-22-41(51)56-30-24-33(2)14-19-38-35(4)16-21-40-45(38,6)26-12-28-47(40,8)43(53)55-10/h31-33,37-40H,3-4,11-30H2,1-2,5-10H3/t32-,33-,37+,38+,39-,40-,44-,45-,46+,47+/m1/s1 |
| InChIKey | ZMJVJGKGJOXWPY-WZVLPDAUSA-N |
| Mol Weight | 778.1 g/mol |
| Molecular Formula | C47H75N3O6 |
| Exact Mass | 777.565587 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FDcDveO4cj2 |
|---|---|
| Name | DIMER-N |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H75N3O6 |
| InChI | InChI=1S/C47H75N3O6/c1-32(13-18-37-34(3)15-20-39-44(37,5)25-11-27-46(39,7)42(52)54-9)23-29-50-31-36(48-49-50)17-22-41(51)56-30-24-33(2)14-19-38-35(4)16-21-40-45(38,6)26-12-28-47(40,8)43(53)55-10/h31-33,37-40H,3-4,11-30H2,1-2,5-10H3/t32-,33-,37+,38+,39-,40-,44-,45-,46+,47+/m1/s1 |
| InChIKey | ZMJVJGKGJOXWPY-WZVLPDAUSA-N |
| Literature Reference Author | M.W.PERTINO,C.THEODULOZ,M.BASTIAS,G.SCHMEDA-HIRSCHMANN |
| Literature Reference Citation | MOLECULES,18,5936(2013) |
| Literature Reference DOI | 10.3390/molecules18055936 |
| Molecular Weight | 778.129 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT9388 |