Dataset

Xanthosine (Not validated)

This MassBank record with Accession MSBNK-RIKEN-PR309133 contains the MS2 mass spectrum of Xanthosine (Not validated) with the InChIkey UBORTCNDUKBEOP-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H12N4O6/c15-1-3-5(16)6(17)9(20-3)14-2-11-4-7(14)12-10(19)13-8(4)18/h2-3,5-6,9,15-17H,1H2,(H2,12,13,18,19)
SMILES OC=1N=C(O)C=2N=CN(C=2(N=1))C3OC(CO)C(O)C3(O)
InChI Key UBORTCNDUKBEOP-UHFFFAOYSA-N
Molecular Formula C10H12N4O6
Exact Mass 284.228 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-PR309133
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T19:35:16.452445
MetadataModified 2025-02-09T18:28:43.860876
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL1880013 ChEMBL
XANTOS CCDC
SCHEMBL21602879 SureChEMBL
1189 PubChem
MCULE-7369311771 Mcule
70120243 NMRShiftDB
PD087000 ProbesDrugs
146-80-5 ACToR
SCHEMBL6676995 SureChEMBL
6795307 eMolecules
4775561 eMolecules
The data in this table is sourced from UniChem at EBI.