Fumonisin Py4
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000941
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000941 contains the MS2 mass spectrum of Fumonisin Py4 with the InChIkey PUZDIGQDECBVJT-FLTFDZFMSA-N.
Source: Fumonisin Py4
Chemical Info
| InChI | InChI=1S/C34H56O14/c1-5-6-14-22(3)32(48-31(42)20-25(34(45)46)18-29(39)40)27(47-30(41)19-24(33(43)44)17-28(37)38)16-21(2)13-11-9-7-8-10-12-15-26(36)23(4)35/h21-22,24-27,32,36H,5-20H2,1-4H3,(H,37,38)(H,39,40)(H,43,44)(H,45,46)/t21-,22+,24+,25+,26-,27-,32+/m0/s1 |
|---|---|
| SMILES | CCCC[C@H]([C@@H](OC(C[C@H](C(O)=O)CC(O)=O)=O)[C@@H](OC(C[C@H](C(O)=O)CC(O)=O)=O)C[C@H](CCCCCCCC[C@H](O)C(C)=O)C)C |
| InChI Key | PUZDIGQDECBVJT-FLTFDZFMSA-N |
| Molecular Formula | C34H56O14 |
| Exact Mass | 688.367 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 | 0bc6efd5-3126-4947-bb7d-ae1c2baaec18 |
| Package id | msbnk-aafc-ac000941 |
| Resource type | HTML |
| State | active |