2',3,3',4,4'-Pentahydroxy-4'-glucosylchalcone,...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS085508
Dataset description:
This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS085508 contains the MS2 mass spectrum of 2',3,3',4,4'-Pentahydroxy-4'-glucosylchalcone, Marein, Okan-4p-Glc,...
Source: 2',3,3',4,4'-Pentahydroxy-4'-glucosylchalcone, Marein, Okan-4p-Glc, okanin-4'-O-glucoside
Chemical Info
| InChI | InChI=1S/C21H22O11/c22-8-15-18(28)19(29)20(30)21(32-15)31-14-6-3-10(16(26)17(14)27)11(23)4-1-9-2-5-12(24)13(25)7-9/h1-7,15,18-22,24-30H,8H2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C=CC(=O)C2=C(C(=C(C=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O)O)O |
| InChI Key | XGEYXJDOVMEJNG-UHFFFAOYSA-N |
| Molecular Formula | C21H22O11 |
| Exact Mass | 450.396 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 4.0 International (CC BY-NC 4.0) |
| Id | e0723886-3e22-49c4-b6cf-2bfeedf6700e |
| Package id | msbnk-riken_respect-ps085508 |
| Resource type | HTML |
| State | active |