Mycophenolic acid
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000682
Dataset description:
This MassBank record with Accession MSBNK-AAFC-AC000682 contains the MS2 mass spectrum of Mycophenolic acid with the InChIkey HPNSFSBZBAHARI-RUDMXATFSA-N.
Source: Mycophenolic acid
Chemical Info
| InChI | InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+ |
|---|---|
| SMILES | CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(\C)/CCC(=O)O)OC |
| InChI Key | HPNSFSBZBAHARI-RUDMXATFSA-N |
| Molecular Formula | C17H20O6 |
| Exact Mass | 320.126 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 | a3cfcf5b-8bda-46f6-af00-b09274c82e2e |
| Package id | msbnk-aafc-ac000682 |
| Resource type | HTML |
| State | active |