Dataset

7,3',4',5'-Tetrahydroxyflavone

This MassBank record with Accession MSBNK-BS-BS003296 contains the MS2 mass spectrum of 7,3',4',5'-Tetrahydroxyflavone with the InChIkey CCCIGFPBADVTFE-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H10O6/c16-8-1-2-9-10(17)6-13(21-14(9)5-8)7-3-11(18)15(20)12(19)4-7/h1-6,16,18-20H
SMILES C1(=C(C2=C(C(=C1O[H])[H])OC(=C(C2=O)[H])C3=C(C(=C(C(=C3[H])O[H])O[H])O[H])[H])[H])[H]
InChI Key CCCIGFPBADVTFE-UHFFFAOYSA-N
Molecular Formula C15H10O6
Exact Mass 286.048 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-BS-BS003296
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:37:00.778271
MetadataModified 2024-01-11T12:37:00.935948
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL398328 ChEMBL
4368658 eMolecules
5393164 PubChem
16719090 PubChem: Thomson Pharma
SCHEMBL158519 SureChEMBL
ZINC000017887543 ZINC
MCULE-1135366305 Mcule
DTXSID70419827 EPA CompTox Dashboard
26661 BindingDB
LMPK12110051 LipidMaps
The data in this table is sourced from UniChem at EBI.