Sophoricoside
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML01310
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML01310 contains the MS2 mass spectrum of Sophoricoside with the InChIkey ISQRJFLLIDGZEP-UHFFFAOYSA-N.
Source: Sophoricoside
Chemical Info
| InChI | InChI=1S/C21H20O10/c22-7-15-18(26)19(27)20(28)21(31-15)30-11-3-1-9(2-4-11)12-8-29-14-6-10(23)5-13(24)16(14)17(12)25/h1-6,8,15,18-24,26-28H,7H2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)OC4C(C(C(C(O4)CO)O)O)O |
| InChI Key | ISQRJFLLIDGZEP-UHFFFAOYSA-N |
| Molecular Formula | C21H20O10 |
| Exact Mass | 432.106 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 2e309cb8-e57f-43d6-9f6f-3befc26ecaef |
| Package id | msbnk-washington_state_univ-bml01310 |
| Resource type | HTML |
| State | active |