Dataset
Dihydrocoumaroyl Hexoside
Chemical Info
InChI | InChI=1S/C15H20O8/c16-7-10-12(19)13(20)14(21)15(23-10)22-9-4-2-1-3-8(9)5-6-11(17)18/h1-4,10,12-16,19-21H,5-7H2,(H,17,18) |
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SMILES | O=C(O)CCC2=CC=CC=C2(OC1OC(CO)C(O)C(O)C1(O)) |
InChI Key | FXEOLMWSBWXMSF-UHFFFAOYSA-N |
Molecular Formula | C15H20O8 |
Exact Mass | 328.317 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-PR309360 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T20:43:07.467990 |
MetadataModified | 2024-01-11T20:43:07.678959 |
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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190904 | ChEBI |
HMDB0038334 | Human Metabolome Database |
73981563 | PubChem |
The data in this table is sourced from UniChem at EBI. |