Dataset

6-Hydroxy-2-aminopurine, 2-Amino-6-hydroxypurine, Guanine, 2-Aminohypoxanthine, 2-Amino-6-oxypurine, Guanine enol

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS024002 contains the MS2 mass spectrum of 6-Hydroxy-2-aminopurine, 2-Amino-6-hydroxypurine, Guanine, 2-Aminohypoxanthine, 2-Amino-6-oxypurine, Guanine enol with the InChIkey UYTPUPDQBNUYGX-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C5H5N5O/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11)
SMILES C1=NC2=C(N1)C(=O)N=C(N2)N
InChI Key UYTPUPDQBNUYGX-UHFFFAOYSA-N
Molecular Formula C5H5N5O
Exact Mass 151.129 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-PS024002
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:07:22.596372
MetadataModified 2024-01-11T21:07:22.753743
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
C00242 KEGG Ligand
CHEMBL219568 ChEMBL
16235 ChEBI
GUN PDBe
228482 Brenda
228483 Brenda
GUANINE rxnorm
GUANINE clinicaltrials
HY-Y1055 MedChemExpress
50200094 BindingDB
4556 Guide to Pharmacology
J9.344K Nikkaji
SCHEMBL16389311 SureChEMBL
KEMDOW CCDC
DTXSID9052476 EPA CompTox Dashboard
135398634 PubChem
16020045 PubChem: Thomson Pharma
16105542 PubChem: Thomson Pharma
14891624 PubChem: Thomson Pharma
11006-44-3 ACToR
gua Recon
5Z93L87A1R FDA SRS
PD039221 ProbesDrugs
1944819 eMolecules
515658 eMolecules
27678147 eMolecules
6217528 eMolecules
628576 eMolecules
SCHEMBL5259 SureChEMBL
MCULE-7938010131 Mcule
10025984 NMRShiftDB
MTBLC16235 Metabolights
ZINC000000895129 ZINC
CB3259805 ChemicalBook
16235 Rhea
HMDB0000132 Human Metabolome Database
199 Brenda
DB02377 DrugBank
49097 Brenda
51287 Brenda
49098 Brenda
102124 Brenda
The data in this table is sourced from UniChem at EBI.