astroside, Biochanin-alpha-7-Glucoside,...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS086801
Dataset description:
This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS086801 contains the MS2 mass spectrum of astroside, Biochanin-alpha-7-Glucoside, Sissotrin, Sissostrin with the InChIkey...
Source: astroside, Biochanin-alpha-7-Glucoside, Sissotrin, Sissostrin
Chemical Info
| InChI | InChI=1S/C22H22O10/c1-29-11-4-2-10(3-5-11)13-9-30-15-7-12(6-14(24)17(15)18(13)25)31-22-21(28)20(27)19(26)16(8-23)32-22/h2-7,9,16,19-24,26-28H,8H2,1H3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)CO)O)O)O |
| InChI Key | LFEUICHQZGNOHD-UHFFFAOYSA-N |
| Molecular Formula | C22H22O10 |
| Exact Mass | 446.408 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 | 91225355-f535-4897-a36e-a50304e536b4 |
| Package id | msbnk-riken_respect-ps086801 |
| Resource type | HTML |
| State | active |