Dataset

Flavone

This MassBank record with Accession MSBNK-RIKEN-PR303170 contains the MS2 mass spectrum of Flavone with the InChIkey VHBFFQKBGNRLFZ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H10O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H
SMILES O=C1C=C(OC2=CC=CC=C12)C1=CC=CC=C1
InChI Key VHBFFQKBGNRLFZ-UHFFFAOYSA-N
Molecular Formula C15H10O2
Exact Mass 222.243 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-RIKEN-PR303170
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:25:29.757437
MetadataModified 2025-02-09T18:26:21.514260
MetadataPublished 2019-03-28
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
DB07776 DrugBank
C15608 KEGG Ligand
CHEMBL275638 ChEMBL
FLN PDBe
409 Guide to Pharmacology
C10043 KEGG Ligand
FLAVONE rxnorm
FLAVONE clinicaltrials
HY-N2424 MedChemExpress
DTXSID2022048 EPA CompTox Dashboard
FLAVONE DailyMed
ZINC000000057674 ZINC
J53.111A Nikkaji
WADRAV CCDC
50028962 BindingDB
LMPK12110097 LipidMaps
1617 Brenda
CB7468498 ChemicalBook
MTBLC42491 Metabolights
84489 Brenda
51326 Brenda
HMDB0003075 Human Metabolome Database
42491 ChEBI
MCULE-3856134714 Mcule
10016211 NMRShiftDB
SCHEMBL18879 SureChEMBL
10680 PubChem
PD002224 ProbesDrugs
S2V45N7G3B FDA SRS
14797981 PubChem: Thomson Pharma
525-82-6 ACToR
11091-19-3 ACToR
511256 eMolecules
The data in this table is sourced from UniChem at EBI.