Peonidin-3-O-alpha-arabinoside
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR303015
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR303015 contains the MS2 mass spectrum of Peonidin-3-O-alpha-arabinoside with the InChIkey KRUPPTWQKIEURV-UHFFFAOYSA-N.
Source: Peonidin-3-O-alpha-arabinoside
Chemical Info
InChI | InChI=1S/C21H20O10/c1-28-16-4-9(2-3-12(16)23)20-17(31-21-19(27)18(26)14(25)8-29-21)7-11-13(24)5-10(22)6-15(11)30-20/h2-7,14,18-19,21,25-27H,8H2,1H3,(H2-,22,23,24) |
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SMILES | COC1=C(O)C=CC(=C1)C1=C(OC2OCC(O)C(O)C2O)C=C2C([O-])=CC(O)=CC2=[O+]1 |
InChI Key | KRUPPTWQKIEURV-UHFFFAOYSA-N |
Molecular Formula | C21H20O10 |
Exact Mass | 432.381 g/mol |
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Additional Information
Field | Value |
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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 | b0b3fb58-c2b7-4376-b36f-669a6986ec37 |
Package id | msbnk-riken-pr303015 |
Resource type | HTML |
State | active |