Dataset

7-Hydroxyflavone

This MassBank record with Accession MSBNK-BS-BS003020 contains the MS2 mass spectrum of 7-Hydroxyflavone with the InChIkey MQGPSCMMNJKMHQ-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C15H10O3/c16-11-6-7-12-13(17)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-9,16H
SMILES	C1(=C(C(=C(C(=C1[H])[H])C2=C(C(=O)C3=C(O2)C(=C(C(=C3[H])[H])O[H])[H])[H])[H])[H])[H]
InChI Key	MQGPSCMMNJKMHQ-UHFFFAOYSA-N
Molecular Formula	C15H10O3
Exact Mass	238.063 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-BS003020
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T12:32:54.195361
MetadataModified	2024-01-11T12:32:54.353002
MetadataPublished	2017-12-01

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CHEMBL276915	ChEMBL
C11264	KEGG Ligand
539181	eMolecules
5281894	PubChem
60024469	NMRShiftDB
PD001140	ProbesDrugs
15464838	PubChem: Thomson Pharma
ZE72458E4L	FDA SRS
LSM-4663	LINCS
6665-86-7	ACToR
LAMDIM	CCDC
MCULE-9296935381	Mcule
SCHEMBL312148	SureChEMBL
J46.306J	Nikkaji
CB9235797	ChemicalBook
150615	Brenda
4336	Brenda
26664	BindingDB
108603	Brenda
56858	Brenda
HY-N7108	MedChemExpress
DTXSID3022328	EPA CompTox Dashboard
2268	ChEBI
ZINC000005934541	ZINC
The data in this table is sourced from UniChem at EBI.