| SpectraBase Compound ID | BAOYwHeDi7R |
|---|---|
| InChI | InChI=1S/C36H36N2O8/c1-45-33-21-25(7-13-31(33)41)19-29(35(43)37-17-15-23-3-9-27(39)10-4-23)30(20-26-8-14-32(42)34(22-26)46-2)36(44)38-18-16-24-5-11-28(40)12-6-24/h3-14,19-22,39-42H,15-18H2,1-2H3,(H,37,43)(H,38,44)/b29-19-,30-20- |
| InChIKey | FGAVHWSCPSBSMG-NAZWXXJZSA-N |
| Mol Weight | 624.7 g/mol |
| Molecular Formula | C36H36N2O8 |
| Exact Mass | 624.247166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LMxVJrSaBw6 |
|---|---|
| Name | HYOSCYAMIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H36N2O8 |
| InChI | InChI=1S/C36H36N2O8/c1-45-33-21-25(7-13-31(33)41)19-29(35(43)37-17-15-23-3-9-27(39)10-4-23)30(20-26-8-14-32(42)34(22-26)46-2)36(44)38-18-16-24-5-11-28(40)12-6-24/h3-14,19-22,39-42H,15-18H2,1-2H3,(H,37,43)(H,38,44)/b29-19-,30-20- |
| InChIKey | FGAVHWSCPSBSMG-NAZWXXJZSA-N |
| Literature Reference Author | C.Y.MA,W.K.LIU,C.T.CHE |
| Literature Reference Citation | J.NAT.PROD.,65,206(2002) |
| Literature Reference DOI | 10.1021/np010073b |
| Molecular Weight | 624.690 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI2816 |