Spiraeoside, Spiraein, quercetin-4'-glucoside,...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS086905
Dataset description:
This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS086905 contains the MS2 mass spectrum of Spiraeoside, Spiraein, quercetin-4'-glucoside, Quer-4p-Glc with the InChIkey...
Source: Spiraeoside, Spiraein, quercetin-4'-glucoside, Quer-4p-Glc
Chemical Info
| InChI | InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)32-11-2-1-7(3-9(11)24)20-18(29)16(27)14-10(25)4-8(23)5-12(14)31-20/h1-5,13,15,17,19,21-26,28-30H,6H2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)OC4C(C(C(C(O4)CO)O)O)O |
| InChI Key | OIUBYZLTFSLSBY-UHFFFAOYSA-N |
| Molecular Formula | C21H20O12 |
| Exact Mass | 464.379 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 | 4005abe4-3f87-4052-b509-bb67c46be4e7 |
| Package id | msbnk-riken_respect-ps086905 |
| Resource type | HTML |
| State | active |