Ethylrhoeagenine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301730
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR301730 contains the MS2 mass spectrum of Ethylrhoeagenine with the InChIkey RKBDCPZCGRWNMP-SJBKTWHCSA-N.
Source: Ethylrhoeagenine
Chemical Info
| InChI | InChI=1S/C22H23NO6/c1-3-24-22-18-13(4-5-15-21(18)28-11-25-15)19-20(29-22)14-9-17-16(26-10-27-17)8-12(14)6-7-23(19)2/h4-5,8-9,19-20,22H,3,6-7,10-11H2,1-2H3/t19-,20-,22+/m1/s1 |
|---|---|
| SMILES | CCO[C@H]1O[C@H]2[C@H](N(C)CCC3=CC4=C(OCO4)C=C23)C2=C1C1=C(OCO1)C=C2 |
| InChI Key | RKBDCPZCGRWNMP-SJBKTWHCSA-N |
| Molecular Formula | C22H23NO6 |
| Exact Mass | 397.427 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 | f1ffd848-b998-4c6e-b4cc-daf03aec07de |
| Package id | msbnk-riken-pr301730 |
| Resource type | HTML |
| State | active |