| SpectraBase Compound ID | fHhbEpRhd |
|---|---|
| InChI | InChI=1S/C50H54N8O13S/c1-29-26-57(48(63)54-45(29)61)43-23-39(42(71-43)28-69-50(32-9-7-6-8-10-32,33-11-17-36(67-4)18-12-33)34-13-19-37(68-5)20-14-34)53-47(56-72(65,66)38-21-15-35(16-22-38)52-31(3)59)51-25-41-40(60)24-44(70-41)58-27-30(2)46(62)55-49(58)64/h6-22,26-27,39-44,60H,23-25,28H2,1-5H3,(H,52,59)(H2,51,53,56)(H,54,61,63)(H,55,62,64)/t39-,40+,41-,42+,43+,44-/m1/s1 |
| InChIKey | GLYLGHDQFVBWPI-GXSPVQLQSA-N |
| Mol Weight | 1007.1 g/mol |
| Molecular Formula | C50H54N8O13S |
| Exact Mass | 1006.353105 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9EGthWSTjmL |
|---|---|
| Name | GLYLGHDQFVBWPI-GXSPVQLQSA-N |
| Compound Number | 6E |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H54N8O13S |
| InChI | InChI=1S/C50H54N8O13S/c1-29-26-57(48(63)54-45(29)61)43-23-39(42(71-43)28-69-50(32-9-7-6-8-10-32,33-11-17-36(67-4)18-12-33)34-13-19-37(68-5)20-14-34)53-47(56-72(65,66)38-21-15-35(16-22-38)52-31(3)59)51-25-41-40(60)24-44(70-41)58-27-30(2)46(62)55-49(58)64/h6-22,26-27,39-44,60H,23-25,28H2,1-5H3,(H,52,59)(H2,51,53,56)(H,54,61,63)(H,55,62,64)/t39-,40+,41-,42+,43+,44-/m1/s1 |
| InChIKey | GLYLGHDQFVBWPI-GXSPVQLQSA-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 |
| Molecular Weight | 1007.085 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP6722 |