Dataset

Kinetin

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81533 contains the MS mass spectrum of Kinetin with the InChIkey QANMHLXAZMSUEX-UHFFFAOYSA-N.

Chemical Info

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-BML81533
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:24:58.005545
MetadataModified 2024-01-11T22:24:58.171554
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL228792 ChEMBL
H35 PDBe
C08272 KEGG Ligand
99431549 PubChem: Drugs of the Future
27678252 eMolecules
513831 eMolecules
1935891 eMolecules
39302 BindingDB
ZINC000000001601 ZINC
3976 DrugCentral
181147 BindingDB
DTXSID9035175 EPA CompTox Dashboard
244031 Brenda
30265 Brenda
96037 Brenda
HY-N0160 MedChemExpress
KINETIN rxnorm
HMDB0012245 Human Metabolome Database
DB11336 DrugBank
3475 Brenda
CB0758226 ChemicalBook
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
KINTIN CCDC
27407 ChEBI
J6.656G Nikkaji
MCULE-2915862970 Mcule
The data in this table is sourced from UniChem at EBI.