| SpectraBase Compound ID | FV8V8jSYfpI |
|---|---|
| InChI | InChI=1S/C31H42N2O6/c1-18-16-32-19(2)25(18)26(35)38-20(3)22-8-9-30-23-7-6-21-14-29(36)11-10-27(21,4)31(23,39-29)24(34)15-28(22,30)17-33(5)12-13-37-30/h7-8,16,20-21,24,32,34,36H,6,9-15,17H2,1-5H3/t20-,21-,24-,27+,28+,29-,30+,31+/m1/s1 |
| InChIKey | ISNYUQWBWALXEY-WVLWVZDSSA-N |
| Mol Weight | 538.7 g/mol |
| Molecular Formula | C31H42N2O6 |
| Exact Mass | 538.304287 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CeYe24Gcfk8 |
|---|---|
| Name | BATRACHOTOXIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H42N2O6 |
| InChI | InChI=1S/C31H42N2O6/c1-18-16-32-19(2)25(18)26(35)38-20(3)22-8-9-30-23-7-6-21-14-29(36)11-10-27(21,4)31(23,39-29)24(34)15-28(22,30)17-33(5)12-13-37-30/h7-8,16,20-21,24,32,34,36H,6,9-15,17H2,1-5H3/t20-,21-,24-,27+,28+,29-,30+,31+/m1/s1 |
| InChIKey | ISNYUQWBWALXEY-WVLWVZDSSA-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 | 538.684 g/mol |
| Solvent | CD3OD |
| Source File Reference | UNIW17278 |