Dataset

6-Oxopurine, Sarcine, HX, Sarkine, Hypoxanthine enol, 6-Hydroxypurine, Sarkin, Hypoxanthine

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS025202 contains the MS2 mass spectrum of 6-Oxopurine, Sarcine, HX, Sarkine, Hypoxanthine enol, 6-Hydroxypurine, Sarkin, Hypoxanthine with the InChIkey FDGQSTZJBFJUBT-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10)
SMILES C1=NC2=C(N1)C(=O)N=CN2
InChI Key FDGQSTZJBFJUBT-UHFFFAOYSA-N
Molecular Formula C5H4N4O
Exact Mass 136.114 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS025202
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:07:36.756211
MetadataModified 2024-01-11T21:07:36.905933
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL1427 ChEMBL
17368 ChEBI
HPA PDBe
C00262 KEGG Ligand
5851666 eMolecules
538926 eMolecules
711446 eMolecules
975947 eMolecules
522216 eMolecules
790 PubChem
PD001959 ProbesDrugs
2TN51YD919 FDA SRS
hxan Recon
184856-40-4 ACToR
14747719 PubChem: Thomson Pharma
hypoxanthine Selleck
99311624 PubChem: Thomson Pharma
16769078 PubChem: Thomson Pharma
16142119 PubChem: Thomson Pharma
15016626 PubChem: Thomson Pharma
J1.934H Nikkaji
10016330 NMRShiftDB
SCHEMBL25381 SureChEMBL
20096821 NMRShiftDB
MCULE-8326019285 Mcule
20181822 NMRShiftDB
4555 Guide to Pharmacology
ZINC000018153302 ZINC
HY-N0091 MedChemExpress
SCHEMBL17276814 SureChEMBL
DTXSID8045983 EPA CompTox Dashboard
GEBTUC CCDC
HMDB0000157 Human Metabolome Database
135398638 PubChem
MTBLC17368 Metabolights
CB5378579 ChemicalBook
17368 Rhea
211 Brenda
DB04076 DrugBank
The data in this table is sourced from UniChem at EBI.