Oxyacanthine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301805
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR301805 contains the MS2 mass spectrum of Oxyacanthine with the InChIkey HGNHIFJNOKGSKI-FICMROCWSA-N.
Source: Oxyacanthine
Chemical Info
| InChI | InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)17-23-8-11-30(40)31(18-23)44-26-9-6-22(7-10-26)16-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29?/m1/s1 |
|---|---|
| SMILES | COC1=C2OC3=C4C(CC5=CC=C(OC6=C(O)C=CC(C[C@H]7N(C)CCC(=C1)C7=C2)=C6)C=C5)N(C)CCC4=CC(OC)=C3OC |
| InChI Key | HGNHIFJNOKGSKI-FICMROCWSA-N |
| Molecular Formula | C37H40N2O6 |
| Exact Mass | 608.735 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 | a661202f-0aa4-4b17-9c29-5a38254894d0 |
| Package id | msbnk-riken-pr301805 |
| Resource type | HTML |
| State | active |