Isoquercetin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BGC_Munich-RP017101
Dataset description:
This MassBank record with Accession MSBNK-BGC_Munich-RP017101 contains the MS2 mass spectrum of Isoquercetin with the InChIkey OVSQVDMCBVZWGM-QSOFNFLRSA-N.
Source: Isoquercetin
Chemical Info
| InChI | InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O |
| InChI Key | OVSQVDMCBVZWGM-QSOFNFLRSA-N |
| Molecular Formula | C21H20O12 |
| Exact Mass | 464.096 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 4.0 International (CC BY 4.0) |
| Id | c1d281d7-2126-40b1-9766-c0a64303ebf6 |
| Package id | msbnk-bgc_munich-rp017101 |
| Resource type | HTML |
| State | active |