Isorhynchophylline
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR300287
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR300287 contains the MS2 mass spectrum of Isorhynchophylline with the InChIkey DAXYUDFNWXHGBE-VKCGGMIFSA-N.
Source: Isorhynchophylline
Chemical Info
| InChI | InChI=1S/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/t14-,15-,19-,22-/m0/s1 |
|---|---|
| SMILES | CC[C@H]1CN2CC[C@]3([C@@H]2C[C@@H]1\C(=C/OC)C(=O)OC)C(O)=NC1=CC=CC=C31 |
| InChI Key | DAXYUDFNWXHGBE-VKCGGMIFSA-N |
| Molecular Formula | C22H28N2O4 |
| Exact Mass | 384.476 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | fe22d107-daaf-4d4a-92cf-09ea49fca695 |
| Package id | msbnk-riken-pr300287 |
| Resource type | HTML |
| State | active |