| SpectraBase Compound ID | JV1p2AQ6Bny |
|---|---|
| InChI | InChI=1S/C40H48N6O10/c1-21-35(49)42-22(2)38(52)44(4)29(18-24-8-13-27(55-7)14-9-24)37(51)43-23(3)39(53)46(6)33-34(48)26-11-15-28(16-12-26)56-32-20-25(10-17-31(32)47)19-30(36(50)41-21)45(5)40(33)54/h8-17,20-23,29-30,33-34,47-48H,18-19H2,1-7H3,(H,41,50)(H,42,49)(H,43,51) |
| InChIKey | TWOWSRSKGJSZHZ-UHFFFAOYSA-N |
| Mol Weight | 772.9 g/mol |
| Molecular Formula | C40H48N6O10 |
| Exact Mass | 772.343192 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5qn5KZ7IFxI |
|---|---|
| Name | Bouvardin |
| CAS Registry Number | 64755-14-2 |
| Comments | reassigned |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C40H48N6O10 |
| InChI | InChI=1S/C40H48N6O10/c1-21-35(49)42-22(2)38(52)44(4)29(18-24-8-13-27(55-7)14-9-24)37(51)43-23(3)39(53)46(6)33-34(48)26-11-15-28(16-12-26)56-32-20-25(10-17-31(32)47)19-30(36(50)41-21)45(5)40(33)54/h8-17,20-23,29-30,33-34,47-48H,18-19H2,1-7H3,(H,41,50)(H,42,49)(H,43,51) |
| InChIKey | TWOWSRSKGJSZHZ-UHFFFAOYSA-N |
| Instrument Name | Bruker WM-250 |
| Literature Reference | R.B. Bates, J.R. Cole, J.J. Hoffmann, J. Am. Chem. Soc. 105, 1343 (1983). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |