Gardenin A
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003608
Dataset description:
This MassBank record with Accession MSBNK-BS-BS003608 contains the MS2 mass spectrum of Gardenin A with the InChIkey MQBFFYQCZCKSBX-UHFFFAOYSA-N.
Source: Gardenin A
Chemical Info
| InChI | InChI=1S/C21H22O9/c1-24-13-7-10(8-14(25-2)17(13)26-3)12-9-11(22)15-16(23)19(27-4)21(29-6)20(28-5)18(15)30-12/h7-9,23H,1-6H3 |
|---|---|
| SMILES | C(OC1=C(C(=C(C(=C1OC([H])([H])[H])OC([H])([H])[H])[H])C2=C(C(=O)C3=C(O2)C(=C(C(=C3O[H])OC([H])([H])[H])OC([H])([H])[H])OC([H])([H])[H])[H])[H])([H])([H])[H] |
| InChI Key | MQBFFYQCZCKSBX-UHFFFAOYSA-N |
| Molecular Formula | C21H22O9 |
| Exact Mass | 418.126 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-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | 1773e676-b456-4ae0-bf6d-fd5ee2348f31 |
| Package id | msbnk-bs-bs003608 |
| Resource type | HTML |
| State | active |