| SpectraBase Compound ID | U1p3QMBbnp |
|---|---|
| InChI | InChI=1S/C47H66N8O10/c1-7-27(4)38-44(62)48-28(5)46(64)54-21-11-16-37(54)43(61)53-39(29(6)56)45(63)50-34(24-30-13-9-8-10-14-30)40(58)51-35(25-31-17-19-32(57)20-18-31)47(65)55-22-12-15-36(55)42(60)49-33(23-26(2)3)41(59)52-38/h8-10,13-14,17-20,26-29,33-39,56-57H,7,11-12,15-16,21-25H2,1-6H3,(H,48,62)(H,49,60)(H,50,63)(H,51,58)(H,52,59)(H,53,61)/t27?,28-,29?,33-,34-,35-,36-,37-,38-,39-/m0/s1 |
| InChIKey | VDGQKFIRUKWWGI-LHYXWHGQSA-N |
| Mol Weight | 903.1 g/mol |
| Molecular Formula | C47H66N8O10 |
| Exact Mass | 902.49019 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3oH8P6GTDWl |
|---|---|
| Name | DICHOTOMIN-H;CYClO-(-ALA-PRO-THR-PHE-TYR-PRO-LEU-ILE-) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H66N8O10 |
| InChI | InChI=1S/C47H66N8O10/c1-7-27(4)38-44(62)48-28(5)46(64)54-21-11-16-37(54)43(61)53-39(29(6)56)45(63)50-34(24-30-13-9-8-10-14-30)40(58)51-35(25-31-17-19-32(57)20-18-31)47(65)55-22-12-15-36(55)42(60)49-33(23-26(2)3)41(59)52-38/h8-10,13-14,17-20,26-29,33-39,56-57H,7,11-12,15-16,21-25H2,1-6H3,(H,48,62)(H,49,60)(H,50,63)(H,51,58)(H,52,59)(H,53,61)/t27?,28-,29?,33-,34-,35-,36-,37-,38-,39-/m0/s1 |
| InChIKey | VDGQKFIRUKWWGI-LHYXWHGQSA-N |
| Literature Reference Author | H.MORITA,K.TAKEYA,H.ITOKAWA |
| Literature Reference Citation | PHYTOCHEM.,45,841(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00056-3 |
| Molecular Weight | 903.089 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSP1596 |