| SpectraBase Compound ID | JNA4t6jctej |
|---|---|
| InChI | InChI=1S/C41H32N4O9/c46-19-10-29(48)21-14-31(50)36(52-32(21)12-19)18-9-27-35(44-25-7-3-1-5-23(25)42-27)37-40(16-18)17-28-38(45-26-8-4-2-6-24(26)43-28)41(37,51)54-34-15-22-30(49)11-20(47)13-33(22)53-39(34)40/h1-8,10-13,16,31,34,36-37,39,46-51H,9,14-15,17H2/t31-,34-,36+,37-,39-,40+,41+/m0/s1 |
| InChIKey | ITOHYNNYZNQNEK-FXZVVIHFSA-N |
| Mol Weight | 724.7 g/mol |
| Molecular Formula | C41H32N4O9 |
| Exact Mass | 724.216929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DQXhCAxtiGV |
|---|---|
| Name | ITOHYNNYZNQNEK-FXZVVIHFSA-N |
| Compound Number | 6A |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H32N4O9 |
| InChI | InChI=1S/C41H32N4O9/c46-19-10-29(48)21-14-31(50)36(52-32(21)12-19)18-9-27-35(44-25-7-3-1-5-23(25)42-27)37-40(16-18)17-28-38(45-26-8-4-2-6-24(26)43-28)41(37,51)54-34-15-22-30(49)11-20(47)13-33(22)53-39(34)40/h1-8,10-13,16,31,34,36-37,39,46-51H,9,14-15,17H2/t31-,34-,36+,37-,39-,40+,41+/m0/s1 |
| InChIKey | ITOHYNNYZNQNEK-FXZVVIHFSA-N |
| Literature Reference Author | Y.MATSUO,Y.YAMADA,T.TANAKA,I.KOUNO |
| Literature Reference Citation | PHYTOCHEM.,69,3054(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.08.007 |
| Molecular Weight | 724.726 g/mol |
| Sample ID | 63845 |
| Solvent | ACETONE-D6 |