Dataset

Kinetin-9-riboside

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81537 contains the MS mass spectrum of Kinetin-9-riboside with the InChIkey CAGLGYNQQSIUGX-SDBHATRESA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H17N5O5/c21-5-9-11(22)12(23)15(25-9)20-7-19-10-13(17-6-18-14(10)20)16-4-8-2-1-3-24-8/h1-3,6-7,9,11-12,15,21-23H,4-5H2,(H,16,17,18)/t9-,11-,12-,15-/m1/s1
SMILES C1=COC(=C1)CNC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O
InChI Key CAGLGYNQQSIUGX-SDBHATRESA-N
Molecular Formula C15H17N5O5
Exact Mass 347.123 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-BML81537
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:28:36.725908
MetadataModified 2024-01-11T22:28:36.898957
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
70073409 NMRShiftDB
PD063763 ProbesDrugs
15977117 PubChem: Thomson Pharma
SCHEMBL3190252 SureChEMBL
LSM-6292 LINCS
BERHAH CCDC
20345 PubChem
J128.130E Nikkaji
95050 ChEBI
50241447 BindingDB
HY-101055 MedChemExpress
ZINC000002169849 ZINC
103239 Brenda
93751 Brenda
175732 Brenda
CB0757845 ChemicalBook
CHEMBL411066 ChEMBL
539823 eMolecules
The data in this table is sourced from UniChem at EBI.