Dataset
Feruloyl lysine
Chemical Info
InChI | InChI=1S/C16H22N2O5/c1-23-14-10-11(5-7-13(14)19)6-8-15(20)18-9-3-2-4-12(17)16(21)22/h5-8,10,12,19H,2-4,9,17H2,1H3,(H,18,20)(H,21,22)/b8-6+ |
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SMILES | COC1=C(O)C=CC(\C=C\C(=O)NCCCCC(N)C(O)=O)=C1 |
InChI Key | VHOPIWUPYREUSE-SOFGYWHQSA-N |
Molecular Formula | C16H22N2O5 |
Exact Mass | 322.361 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-PR311016 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T19:54:09.671016 |
MetadataModified | 2025-02-09T18:30:09.772645 |
MetadataPublished | 2019-03-28 |
Related Molecule |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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102301053 | PubChem |
J2.791.175G | Nikkaji |
The data in this table is sourced from UniChem at EBI. |