Dp 3-Glc, Delphinidin-3-glucoside, Myrtillin,...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PT112170
Dataset description:
This MassBank record with Accession MSBNK-RIKEN_ReSpect-PT112170 contains the MS2 mass spectrum of Dp 3-Glc, Delphinidin-3-glucoside, Myrtillin, Delphinidin-3-O-beta-glucopyranoside,...
Chemical Info
| InChI | InChI=1S/C21H20O12/c22-6-15-17(28)18(29)19(30)21(33-15)32-14-5-9-10(24)3-8(23)4-13(9)31-20(14)7-1-11(25)16(27)12(26)2-7/h1-5,15,17-19,21-22,28-30H,6H2,(H4-,23,24,25,26,27)/p+1 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)OC4C(C(C(C(O4)CO)O)O)O |
| InChI Key | XENHPQQLDPAYIJ-UHFFFAOYSA-O |
| Molecular Formula | [C21H21O12]+ |
| Exact Mass | 465.387 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 | 14254798-c0bf-459b-be80-a60750bd650c |
| Package id | msbnk-riken_respect-pt112170 |
| Resource type | HTML |
| State | active |