EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:44841 - 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-one

ChEBI IDCHEBI:44841
ChEBI Name2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-one
Stars
DefinitionA dihydropterin that is 7,8-dihydropteridin-4-one substituted at positions 2 and 6 by amino and hydroxymethyl groups respectively.
Last Modified6 March 2015
DownloadsMolfile
FormulaC7H9N5O2
Net Charge0
Average Mass195.182
Monoisotopic Mass195.07562
SMILESNc1nc2c(c(=O)n1)N=C(CO)CN2
InChIInChI=1S/C7H9N5O2/c8-7-11-5-4(6(14)12-7)10-3(2-13)1-9-5/h13H,1-2H2,(H4,8,9,11,12,14)
InChIKeyCQQNNQTXUGLUEV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-one (CHEBI:44841) is a dihydropterin (CHEBI:38797)
2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-one (CHEBI:44841) is tautomer of 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-ol (CHEBI:17083)
Incoming Relation(s)
2-amino-6-hydroxymethyl-7,7-dimethyl-7,8-dihydropteridin-4-one (CHEBI:73981) has functional parent 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-one (CHEBI:44841)
2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-ol (CHEBI:17083) is tautomer of 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-one (CHEBI:44841)
IUPAC Name 
2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4(3H)-one
Synonym  Source
2-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-3H-PTERIDIN-4-ONEPDBeChem
UniProt Name  Source
6-hydroxymethyl-7,8-dihydropterinUniProt
Manual XrefsDatabases
C01300KEGG COMPOUND
PH2PDBeChem
Registry NumbersSources
Reaxys:5018822Reaxys