N2-Ethyl-2'-deoxyguanosine (CHEBI:195593)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	N2-Ethyl-2'-deoxyguanosine

ChEBI ID	CHEBI:195593

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H17N5O4

Net Charge

Average Mass

295.299

Monoisotopic Mass

295.12805

InChI

InChI=1S/C12H17N5O4/c1-2-13-12-15-10-9(11(20)16-12)14-5-17(10)8-3-6(19)7(4-18)21-8/h5-8,18-19H,2-4H2,1H3,(H2,13,15,16,20)/t6-,7+,8+/m0/s1

InChIKey

VOKQFDULHQUWAV-XLPZGREQSA-N

SMILES

O1[C@@H](N2C=3N=C(NC(=O)C3N=C2)NCC)C[C@H](O)[C@H]1CO

Metabolite of Species	Details
Apis mellifera (NCBI:txid7460)	Found in ovary (BTO:0000975). See: MetaboLights Study

ChEBI Ontology
Outgoing	N2-Ethyl-2'-deoxyguanosine (CHEBI:195593) is a purine 2'-deoxyribonucleoside (CHEBI:19254)

IUPAC Name

2-(ethylamino)-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one

Last Modified

06 September 2023