Dataset

Daidzein

This MassBank record with Accession MSBNK-UFZ-UF416352 contains the MS2 mass spectrum of Daidzein with the InChIkey ZQSIJRDFPHDXIC-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H
SMILES OC1=CC=C(C=C1)C1=COC2=CC(O)=CC=C2C1=O
InChI Key ZQSIJRDFPHDXIC-UHFFFAOYSA-N
Molecular Formula C15H10O4
Exact Mass 254.058 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF416352
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:01:23.714249
MetadataModified 2025-02-09T19:49:34.025964
MetadataPublished 2017-01-05
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
5281708 PubChem
206527 Brenda
HMDB0003312 Human Metabolome Database
28121 Brenda
124333 Brenda
56863 Brenda
124050 Brenda
CB7173989 ChemicalBook
DB13182 DrugBank
MTBLC28197 Metabolights
848 Brenda
183691 Brenda
LMPK12050038 LipidMaps
DTXSID9022310 EPA CompTox Dashboard
14847806 PubChem: Thomson Pharma
HY-N0019 MedChemExpress
DAIDZEIN clinicaltrials
49684218 PubChem: Drugs of the Future
C10208 KEGG Ligand
CHEMBL8145 ChEMBL
2828 Guide to Pharmacology
28197 ChEBI
486-66-8 ACToR
Daidzein Selleck
MCULE-8239511422 Mcule
SCHEMBL19814 SureChEMBL
LSM-2935 LINCS
6287WC5J2L FDA SRS
PD002203 ProbesDrugs
ZINC000018847034 ZINC
23420 BindingDB
J6.014C Nikkaji
XEKCUO CCDC
ZF1 PDBe
60015845 NMRShiftDB
496368 eMolecules
The data in this table is sourced from UniChem at EBI.