Dataset
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 |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-nc-sa/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR303029 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T20:41:37.046756 |
MetadataModified | 2024-01-11T20:41:37.209229 |
MetadataPublished | 2019-03-28 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |