Dataset

3,6,3',4'-Tetrahydroxyflavone

This MassBank record with Accession MSBNK-BS-BS003448 contains the MS2 mass spectrum of 3,6,3',4'-Tetrahydroxyflavone with the InChIkey BXPBSBBFPNTFFT-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H10O6/c16-8-2-4-12-9(6-8)13(19)14(20)15(21-12)7-1-3-10(17)11(18)5-7/h1-6,16-18,20H
SMILES C1=C(C=C2C(=C1)OC(=C(C2=O)O)C3=CC=C(C(=C3)O)O)O
InChI Key BXPBSBBFPNTFFT-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-BS003448
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:35:44.485408
MetadataModified 2024-01-11T12:35:44.656693
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
4368656 eMolecules
CHEMBL1224325 ChEMBL
220668 Brenda
ZINC000000008662 ZINC
6JM PDBe
MCULE-4175791788 Mcule
14751112 PubChem: Thomson Pharma
SCHEMBL505584 SureChEMBL
667581 PubChem
The data in this table is sourced from UniChem at EBI.