| SpectraBase Compound ID | 4QtT1sQhIol |
|---|---|
| InChI | InChI=1S/C33H46N2O6/c1-7-24-27(20(2)18-34-24)28(37)40-21(3)23-10-11-32-25-9-8-22-16-31(38-6)13-12-29(22,4)33(25,41-31)26(36)17-30(23,32)19-35(5)14-15-39-32/h9-10,18,21-22,26,34,36H,7-8,11-17,19H2,1-6H3/t21-,22-,26-,29+,30+,31-,32+,33+/m1/s1 |
| InChIKey | UJQZUMJUBFSUFZ-LCYWNJRZSA-N |
| Mol Weight | 566.7 g/mol |
| Molecular Formula | C33H46N2O6 |
| Exact Mass | 566.335587 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J9RxjJkUPRF |
|---|---|
| Name | HOMOBATRACHOTOXIN-3-METHYLETHER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H46N2O6 |
| InChI | InChI=1S/C33H46N2O6/c1-7-24-27(20(2)18-34-24)28(37)40-21(3)23-10-11-32-25-9-8-22-16-31(38-6)13-12-29(22,4)33(25,41-31)26(36)17-30(23,32)19-35(5)14-15-39-32/h9-10,18,21-22,26,34,36H,7-8,11-17,19H2,1-6H3/t21-,22-,26-,29+,30+,31-,32+,33+/m1/s1 |
| InChIKey | UJQZUMJUBFSUFZ-LCYWNJRZSA-N |
| Literature Reference Author | T.TOKUYAMA,J.W.DALY |
| Literature Reference Citation | TETRAHEDRON,39,41(1983) |
| Literature Reference DOI | 10.1016/S0040-4020(01)97627-6 |
| Molecular Weight | 566.738 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSF120 |