Dataset

6,7-Dihydroxycoumarin-6-glucoside

This MassBank record with Accession MSBNK-RIKEN-PR306885 contains the MS2 mass spectrum of 6,7-Dihydroxycoumarin-6-glucoside with the InChIkey XHCADAYNFIFUHF-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2
SMILES OCC1OC(OC2=C(O)C=C3OC(=O)C=CC3=C2)C(O)C(O)C1O
InChI Key XHCADAYNFIFUHF-UHFFFAOYSA-N
Molecular Formula C15H16O9
Exact Mass 340.284 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR306885
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:40:25.674046
MetadataModified 2024-01-11T20:40:25.848758
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
5351506 PubChem
PD056307 ProbesDrugs
SCHEMBL2894 SureChEMBL
531-75-9 ACToR
10017721 NMRShiftDB
1971448 eMolecules
237203 BindingDB
SCHEMBL20179973 SureChEMBL
CHEMBL359043 ChEMBL
MCULE-7396618201 Mcule
The data in this table is sourced from UniChem at EBI.