Dataset

5,4'-Dihydroxy-7-methoxyflavone (Genkwanin, 7-methoxyapigenin)

This MassBank record with Accession MSBNK-BS-BS003745 contains the MS2 mass spectrum of 5,4'-Dihydroxy-7-methoxyflavone (Genkwanin, 7-methoxyapigenin) with the InChIkey JPMYFOBNRRGFNO-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C16H12O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3
SMILES C(OC1=C(C(=C2C(=C1[H])OC(=C(C2=O)[H])C3=C(C(=C(C(=C3[H])[H])O[H])[H])[H])O[H])[H])([H])([H])[H]
InChI Key JPMYFOBNRRGFNO-UHFFFAOYSA-N
Molecular Formula C16H12O5
Exact Mass 284.068 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-BS003745
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:38:07.403856
MetadataModified 2025-02-09T08:51:11.482391
MetadataPublished 2017-12-01
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
C10046 KEGG Ligand
CHEMBL210635 ChEMBL
NORSUL CCDC
HMDB0252684 Human Metabolome Database
LMPK12111018 LipidMaps
DTXSID80195908 EPA CompTox Dashboard
MCULE-4718928065 Mcule
HY-N0731 MedChemExpress
232571 Brenda
13401 Brenda
84089 Brenda
51466 Brenda
50187658 BindingDB
J61.256A Nikkaji
60019854 NMRShiftDB
14948337 PubChem: Thomson Pharma
437-64-9 ACToR
PD086891 ProbesDrugs
5281617 PubChem
890555 eMolecules
CB7732333 ChemicalBook
ZINC000005732375 ZINC
MTBLC75718 Metabolights
75718 ChEBI
5K3I5D6B2B FDA SRS
SCHEMBL866123 SureChEMBL
The data in this table is sourced from UniChem at EBI.