Dataset

Kaempferol; LC-ESI-QTOF; MS

This MassBank record with Accession MSBNK-BS-BS003361 contains the MS mass spectrum of Kaempferol with the InChIkey IYRMWMYZSQPJKC-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H
SMILES C1(=C(C(=C(C(=C1C2=C(C(=O)C3=C(C(=C(C(=C3O2)[H])O[H])[H])O[H])O[H])[H])[H])O[H])[H])[H]
InChI Key IYRMWMYZSQPJKC-UHFFFAOYSA-N
Molecular Formula C15H10O6
Exact Mass 286.048 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-BS003361
Version
Author
Maintainer
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MetadataPublished 2017-12-01
Related Molecule
  • 3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    7628 Brenda
    408 Brenda
    HMDB0005801 Human Metabolome Database
    CB5223176 ChemicalBook
    ZINC000003869768 ZINC
    MTBLC28499 Metabolights
    62438 Brenda
    35794 Brenda
    SCHEMBL18817 SureChEMBL
    5280863 PubChem
    PD000231 ProbesDrugs
    14751111 PubChem: Thomson Pharma
    520-18-3 ACToR
    Kaempferol Selleck
    LSM-5304 LINCS
    524531 eMolecules
    EJEPOA CCDC
    J1.575J Nikkaji
    LMPK12110003 LipidMaps
    DTXSID7020768 EPA CompTox Dashboard
    43511 Brenda
    243651 Brenda
    HY-14590 MedChemExpress
    11052 Guide to Pharmacology
    60005037 NMRShiftDB
    7462 BindingDB
    MCULE-8965218413 Mcule
    731P2LE49E FDA SRS
    DB01852 DrugBank
    56310599 PubChem: Drugs of the Future
    CHEMBL150 ChEMBL
    KMP PDBe
    28499 ChEBI
    C05903 KEGG Ligand
    The data in this table is sourced from UniChem at EBI.