Liquiritin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR310484
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR310484 contains the MS2 mass spectrum of Liquiritin with the InChIkey DEMKZLAVQYISIA-UHFFFAOYSA-N.
Source: Liquiritin
Chemical Info
| InChI | InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2 |
|---|---|
| SMILES | O=C3C=4C=CC(O)=CC=4(OC(C2=CC=C(OC1OC(CO)C(O)C(O)C1(O))C=C2)C3) |
| InChI Key | DEMKZLAVQYISIA-UHFFFAOYSA-N |
| Molecular Formula | C21H22O9 |
| Exact Mass | 418.398 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 | a9234202-ef87-4405-bdd3-025f6a32fbfc |
| Package id | msbnk-riken-pr310484 |
| Resource type | HTML |
| State | active |