Kopsinoline
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR300092
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR300092 contains the MS2 mass spectrum of Kopsinoline with the InChIkey KWXHCCIXBUPHTG-ICLMVOIRSA-N.
Source: Kopsinoline
Chemical Info
| InChI | InChI=1S/C21H26N2O3/c1-26-17(24)15-13-19-7-4-11-23(25)12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18+,19-,20-,21-,23+/m0/s1 |
|---|---|
| SMILES | COC(=O)[C@@H]1C[C@@]23CCC[N@@]4(=O)CC[C@@]5([C@@H]24)C2=CC=CC=C2N[C@@]15CC3 |
| InChI Key | KWXHCCIXBUPHTG-ICLMVOIRSA-N |
| Molecular Formula | C21H26N2O3 |
| Exact Mass | 354.450 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 | ec24dbae-51bf-47ad-8c14-9f26764ff998 |
| Package id | msbnk-riken-pr300092 |
| Resource type | HTML |
| State | active |