| SpectraBase Compound ID | 5VAIJwkr5Nj |
|---|---|
| InChI | InChI=1S/C23H30N2O5/c1-5-14-12-25-10-9-23(27)20-17(7-6-8-19(20)29-3)24-21(23)18(25)11-15(14)16(13-28-2)22(26)30-4/h6-8,13-15,18,27H,5,9-12H2,1-4H3/b16-13+/t14-,15+,18+,23+/m1/s1 |
| InChIKey | RYENLSMHLCNXJT-CYXFISRXSA-N |
| Mol Weight | 414.5 g/mol |
| Molecular Formula | C23H30N2O5 |
| Exact Mass | 414.215472 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FY8zula82wX |
|---|---|
| Name | 7-hydroxy Mitragynine |
| Catalog Number | 13114 |
| CAS Registry Number | 174418-82-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H30N2O5 |
| InChI | InChI=1S/C23H30N2O5/c1-5-14-12-25-10-9-23(27)20-17(7-6-8-19(20)29-3)24-21(23)18(25)11-15(14)16(13-28-2)22(26)30-4/h6-8,13-15,18,27H,5,9-12H2,1-4H3/b16-13+/t14-,15+,18+,23+/m1/s1 |
| InChIKey | RYENLSMHLCNXJT-CYXFISRXSA-N |
| Molecular Weight | 414.502 g/mol |
| SMILES | O[C@]12C(=Nc3cccc(c13)OC)[C@]1(N(CC2)C[C@]([C@](C1)(\C(=C/OC)C(=O)OC)[H])(CC)[H])[H] |
| SPLASH | splash10-000i-5691000000-29f69f40d307a6aa4ec0 |
| Source of Spectrum | CAY-2023-702-0 |
| Wiley ID | 1888661 |