Gardenin A
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003611
Dataset description:
This MassBank record with Accession MSBNK-BS-BS003611 contains the MS 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 |
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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 |
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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 | 6d01e8d1-04bd-4150-a0ab-edf1a0047dc7 |
Package id | msbnk-bs-bs003611 |
Resource type | HTML |
State | active |