Cyanidin-3-O-alpha-arabinoside
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR303256
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR303256 contains the MS2 mass spectrum of Cyanidin-3-O-alpha-arabinoside with the InChIkey KUCVMQMKRICXJC-VLNXYBQZSA-O.
Source: Cyanidin-3-O-alpha-arabinoside
Chemical Info
InChI | InChI=1S/C20H18O10/c21-9-4-12(23)10-6-16(30-20-18(27)17(26)14(25)7-28-20)19(29-15(10)5-9)8-1-2-11(22)13(24)3-8/h1-6,14,17-18,20,25-27H,7H2,(H3-,21,22,23,24)/p+1/t14-,17?,18?,20-/m0/s1 |
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SMILES | O[C@H]1CO[C@@H](OC2=C([O+]=C3C=C(O)C=C(O)C3=C2)C2=CC(O)=C(O)C=C2)C(O)C1O |
InChI Key | KUCVMQMKRICXJC-VLNXYBQZSA-O |
Molecular Formula | [C20H19O10]+ |
Exact Mass | 419.362 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 | 14482684-d275-43b1-a494-84dce8f097f0 |
Package id | msbnk-riken-pr303256 |
Resource type | HTML |
State | active |