| SpectraBase Compound ID | 6gCNoxX4oJD |
|---|---|
| InChI | InChI=1S/2C40H40N4O10S/c2*1-2-21-53-39(47)41-17-9-19-42(40(48)54-27-35-33-13-5-3-11-31(33)32-12-4-6-14-34(32)35)25-28-22-29(24-30(23-28)38(45)46)26-43(20-10-18-41)55(51,52)37-16-8-7-15-36(37)44(49)50/h2*2-8,11-16,22-24,35H,1,9-10,17-21,25-27H2,(H,45,46) |
| InChIKey | QIJWJQRFRJZBMT-UHFFFAOYSA-N |
| Mol Weight | 1537.7 g/mol |
| Molecular Formula | C80H80N8O20S2 |
| Exact Mass | 1536.493029 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KFBrHEfldK5 |
|---|---|
| Name | QIJWJQRFRJZBMT-UHFFFAOYSA-N |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C80H80N8O20S2 |
| InChI | InChI=1S/2C40H40N4O10S/c2*1-2-21-53-39(47)41-17-9-19-42(40(48)54-27-35-33-13-5-3-11-31(33)32-12-4-6-14-34(32)35)25-28-22-29(24-30(23-28)38(45)46)26-43(20-10-18-41)55(51,52)37-16-8-7-15-36(37)44(49)50/h2*2-8,11-16,22-24,35H,1,9-10,17-21,25-27H2,(H,45,46) |
| InChIKey | QIJWJQRFRJZBMT-UHFFFAOYSA-N |
| Literature Reference Author | T.OPATZ,R.M.J.LISKAMP |
| Literature Reference Citation | ORG.LETTERS,3,3499(2001) |
| Literature Reference DOI | 10.1021/ol0101741 |
| Molecular Weight | 1537.677 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU35790 |