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CHEBI:192114 - 1,N2-propanodeoxyguanosine

ChEBI IDCHEBI:192114
ChEBI Name1,N2-propanodeoxyguanosine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H17N5O4
Net Charge0
Average Mass307.310
Monoisotopic Mass307.12805
SMILESO=c1c2ncn([C@H]3C[C@H](O)[C@@H](CO)O3)c2nc2n1CCCN2
InChIInChI=1S/C13H17N5O4/c19-5-8-7(20)4-9(22-8)18-6-15-10-11(18)16-13-14-2-1-3-17(13)12(10)21/h6-9,19-20H,1-5H2,(H,14,16)/t7-,8+,9+/m0/s1
InChIKeyHGYWFMCWAWUWRE-DJLDLDEBSA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
ChEBI Ontology
Outgoing Relation(s)
1,N2-propanodeoxyguanosine (CHEBI:192114) is a carbohydrate derivative (CHEBI:63299)
1,N2-propanodeoxyguanosine (CHEBI:192114) is a nucleobase-containing molecular entity (CHEBI:61120)
IUPAC Name 
3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,6,7,8-tetrahydropyrimido[1,2-a]purin-10-one
Manual XrefsDatabases
HMDB0059780HMDB
4588654ChemSpider
Registry NumbersSources
CAS:120667-07-4ChemIDplus