Acacetin-5-O-xyloside
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003726
Dataset description:
This MassBank record with Accession MSBNK-BS-BS003726 contains the MS2 mass spectrum of Acacetin-5-O-xyloside with the InChIkey NCCOYBTYDAMVTO-ZQEFQCJFSA-N.
Source: Acacetin-5-O-xyloside
Chemical Info
| InChI | InChI=1S/C21H20O9/c1-27-12-4-2-10(3-5-12)15-8-13(23)18-16(29-15)6-11(22)7-17(18)30-21-20(26)19(25)14(24)9-28-21/h2-8,14,19-22,24-26H,9H2,1H3/t14-,19+,20-,21+/m1/s1 |
|---|---|
| SMILES | C1(=CC(=C2C(=C1)OC(=CC2=O)C3=CC=C(OC)C=C3)O[C@H]4[C@@H]([C@H]([C@@H](CO4)O)O)O)O |
| InChI Key | NCCOYBTYDAMVTO-ZQEFQCJFSA-N |
| Molecular Formula | C21H20O9 |
| Exact Mass | 416.111 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 | e12a12ca-3061-4dbd-afe3-039d1544f75f |
| Package id | msbnk-bs-bs003726 |
| Resource type | HTML |
| State | active |