Dataset

Kinetin; LC-ESI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81530 contains the MS mass spectrum of Kinetin with the InChIkey QANMHLXAZMSUEX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H9N5O/c1-2-7(16-3-1)4-11-9-8-10(13-5-12-8)15-6-14-9/h1-3,5-6H,4H2,(H2,11,12,13,14,15)
SMILES C1=COC(=C1)CNC2=NC=NC3=C2NC=N3
InChI Key QANMHLXAZMSUEX-UHFFFAOYSA-N
Molecular Formula C10H9N5O
Exact Mass 215.081 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81530
Version
Author
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MetadataPublished 2016-01-19
Related Molecule
  • N-(furan-2-ylmethyl)-7H-purin-6-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CB0758226 ChemicalBook
    3475 Brenda
    DB11336 DrugBank
    HMDB0012245 Human Metabolome Database
    27407 ChEBI
    MCULE-2915862970 Mcule
    14818865 PubChem: Thomson Pharma
    15195825 PubChem: Thomson Pharma
    60025471 NMRShiftDB
    PD001590 ProbesDrugs
    kinetin Atlas
    P39Y9652YJ FDA SRS
    LSM-5740 LINCS
    9001-54-1 ACToR
    956-31-0 ACToR
    6046-79-3 ACToR
    33446-70-7 ACToR
    SCHEMBL15705 SureChEMBL
    Kinetin(6-Furfuryladenine) Selleck
    3830 PubChem
    27678252 eMolecules
    513831 eMolecules
    1935891 eMolecules
    96037 Brenda
    181147 BindingDB
    39302 BindingDB
    HY-N0160 MedChemExpress
    30265 Brenda
    244031 Brenda
    J6.656G Nikkaji
    DTXSID9035175 EPA CompTox Dashboard
    ZINC000000001601 ZINC
    3976 DrugCentral
    KINTIN CCDC
    KINETIN rxnorm
    99431549 PubChem: Drugs of the Future
    CHEMBL228792 ChEMBL
    H35 PDBe
    C08272 KEGG Ligand
    The data in this table is sourced from UniChem at EBI.