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

molecular Image
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

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 2024-01-11T12:34:13.810065
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
56310581 PubChem: Drugs of the Future
CHEMBL243664 ChEMBL
C01470 KEGG Ligand
HY-N0451 MedChemExpress
91589 Brenda
MCULE-8773156096 Mcule
DTXSID00197383 EPA CompTox Dashboard
23415 BindingDB
ZINC000003871358 ZINC
J6.166B Nikkaji
DAXMFV CCDC
LMPK12110468 LipidMaps
CB9316535 ChemicalBook
MTBLC15335 Metabolights
15335 ChEBI
125030 Brenda
4661 Brenda
14039 Brenda
60022381 NMRShiftDB
PD037100 ProbesDrugs
15369193 PubChem: Thomson Pharma
LSM-6662 LINCS
480-44-4 ACToR
KWI7J0A2CC FDA SRS
474250 eMolecules
SCHEMBL107712 SureChEMBL
5280442 PubChem
The data in this table is sourced from UniChem at EBI.