Dataset

5,7-Dihydroxy-4'-methoxyflavone

This MassBank record with Accession MSBNK-BS-BS003807 contains the MS2 mass spectrum of 5,7-Dihydroxy-4'-methoxyflavone with the InChIkey DANYIYRPLHHOCZ-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3
SMILES	C(OC1=C(C(=C(C(=C1[H])[H])C2=C(C(=O)C3=C(C(=C(C(=C3O2)[H])O[H])[H])O[H])[H])[H])[H])([H])([H])[H]
InChI Key	DANYIYRPLHHOCZ-UHFFFAOYSA-N
Molecular Formula	C16H12O5
Exact Mass	284.068 g/mol

Data and Resources

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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-BS003807
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T12:34:13.653088
MetadataModified	2025-02-09T08:53:39.494652
MetadataPublished	2017-12-01

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
SCHEMBL107712	SureChEMBL
ZINC000003871358	ZINC
CB9316535	ChemicalBook
14039	Brenda
4661	Brenda
125030	Brenda
MTBLC15335	Metabolights
474250	eMolecules
5280442	PubChem
60022381	NMRShiftDB
15369193	PubChem: Thomson Pharma
KWI7J0A2CC	FDA SRS
LSM-6662	LINCS
480-44-4	ACToR
PD037100	ProbesDrugs
56310581	PubChem: Drugs of the Future
CHEMBL243664	ChEMBL
C01470	KEGG Ligand
LMPK12110468	LipidMaps
23415	BindingDB
HY-N0451	MedChemExpress
J6.166B	Nikkaji
DTXSID00197383	EPA CompTox Dashboard
91589	Brenda
MCULE-8773156096	Mcule
DAXMFV	CCDC
15335	ChEBI
The data in this table is sourced from UniChem at EBI.