Dataset

Genistein

This MassBank record with Accession MSBNK-RIKEN-PR305509 contains the MS2 mass spectrum of Genistein with the InChIkey TZBJGXHYKVUXJN-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H
SMILES OC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O
InChI Key TZBJGXHYKVUXJN-UHFFFAOYSA-N
Molecular Formula C15H10O5
Exact Mass 270.240 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-PR305509
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:34:44.573108
MetadataModified 2025-02-09T18:31:08.860472
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
28088 ChEBI
GEN PDBe
49684188 PubChem: Drugs of the Future
C06563 KEGG Ligand
DB01645 DrugBank
CHEMBL44 ChEMBL
2826 Guide to Pharmacology
229472 Brenda
GENISTEIN rxnorm
GENISTEIN clinicaltrials
GENIST CCDC
J39.883G Nikkaji
BIO-300 clinicaltrials
HY-14596 MedChemExpress
43512 Brenda
LMPK12050218 LipidMaps
DTXSID5022308 EPA CompTox Dashboard
377 Brenda
229473 Brenda
19459 BindingDB
5280961 PubChem
60023796 NMRShiftDB
PD002146 ProbesDrugs
genestein Atlas
genistein Atlas
15197341 PubChem: Thomson Pharma
LSM-5549 LINCS
446-72-0 ACToR
SCHEMBL19166 SureChEMBL
Genistein Selleck
DH2M523P0H FDA SRS
532754 eMolecules
27105 Brenda
CB6163787 ChemicalBook
56864 Brenda
PA165109660 PharmGKB
HMDB0003217 Human Metabolome Database
164054 Brenda
MTBLC28088 Metabolights
ZINC000018825330 ZINC
MCULE-4857649752 Mcule
The data in this table is sourced from UniChem at EBI.