isookanin-7-O-glucoside
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR306044
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR306044 contains the MS2 mass spectrum of isookanin-7-O-glucoside with the InChIkey DGGOLFCPSUVVHX-UHFFFAOYSA-N.
Source: isookanin-7-O-glucoside
Chemical Info
| InChI | InChI=1S/C21H22O11/c22-7-15-16(26)18(28)19(29)21(32-15)31-13-4-2-9-11(24)6-14(30-20(9)17(13)27)8-1-3-10(23)12(25)5-8/h1-5,14-16,18-19,21-23,25-29H,6-7H2 |
|---|---|
| SMILES | OCC1OC(OC2=C(O)C3=C(C=C2)C(=O)CC(O3)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O |
| InChI Key | DGGOLFCPSUVVHX-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-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | 0af19b2d-ff0b-4652-8195-8783232cc885 |
| Package id | msbnk-riken-pr306044 |
| Resource type | HTML |
| State | active |