CHEBI:192114 - 1,N2-propanodeoxyguanosine

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 1,N2-propanodeoxyguanosine
ChEBI ID CHEBI:192114
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C13H17N5O4
Net Charge 0
Average Mass 307.310
Monoisotopic Mass 307.12805
InChI InChI=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
InChIKey HGYWFMCWAWUWRE-DJLDLDEBSA-N
SMILES O1[C@@H](N2C=3N=C4N(CCCN4)C(=O)C3N=C2)C[C@H](O)[C@H]1CO
Metabolite of Species Details
Marine plankton environmental sample (NCBI:txid632957) Found in endometabolome (MTBLS:000125). See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xrefs Databases
4588654 ChemSpider
HMDB0059780 HMDB
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Registry Number Type Source
120667-07-4 CAS Registry Number ChemIDplus