NX2 toxin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000400
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000400 contains the MS2 mass spectrum of NX2 toxin with the InChIkey NKCFJIIVGLENIK-NOCMYWHHSA-N.
Source: NX2 toxin
Chemical Info
| InChI | InChI=1S/C17H24O6/c1-9-4-12(20)16(7-18)13(5-9)23-14-11(22-10(2)19)6-15(16,3)17(14)8-21-17/h5,11-14,18,20H,4,6-8H2,1-3H3/t11-,12-,13-,14-,15-,16+,17+/m1/s1 |
|---|---|
| SMILES | CC1=C[C@@H]2[C@]([C@@]3(C)C[C@@H](OC(C)=O)[C@@H](O2)[C@@]34CO4)(CO)[C@H](O)C1 |
| InChI Key | NKCFJIIVGLENIK-NOCMYWHHSA-N |
| Molecular Formula | C17H24O6 |
| Exact Mass | 324.157 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 738efb38-a7b7-4963-ba6c-4a952848806c |
| Package id | msbnk-aafc-ac000400 |
| Resource type | HTML |
| State | active |