11,12-Methylenedioxykopsinaline
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR300101
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR300101 contains the MS2 mass spectrum of 11,12-Methylenedioxykopsinaline with the InChIkey JVIKUDVTJCANPX-NBYDKTAJSA-N.
Source: 11,12-Methylenedioxykopsinaline
Chemical Info
| InChI | InChI=1S/C22H26N2O5/c1-27-18(25)21(26)11-19-5-2-9-24-10-8-20(17(19)24)13-3-4-14-16(29-12-28-14)15(13)23-22(20,21)7-6-19/h3-4,17,23,26H,2,5-12H2,1H3/t17-,19+,20+,21+,22-/m0/s1 |
|---|---|
| SMILES | COC(=O)[C@]1(O)C[C@]23CCCN4CC[C@]5([C@H]24)C2=C(N[C@]15CC3)C1=C(OCO1)C=C2 |
| InChI Key | JVIKUDVTJCANPX-NBYDKTAJSA-N |
| Molecular Formula | C22H26N2O5 |
| Exact Mass | 398.459 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 | a02baf61-eefe-4547-ad20-1890fc2dcd62 |
| Package id | msbnk-riken-pr300101 |
| Resource type | HTML |
| State | active |