6-oxo-famciclovir (CHEBI:196591)

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	6-oxo-famciclovir

ChEBI ID	CHEBI:196591

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H19N5O5

Net Charge

Average Mass

337.336

Monoisotopic Mass

337.13862

InChI

InChI=1S/C14H19N5O5/c1-8(20)23-5-10(6-24-9(2)21)3-4-19-7-16-11-12(19)17-14(15)18-13(11)22/h7,10H,3-6H2,1-2H3,(H3,15,17,18,22)

InChIKey

KQURMIWGELPUHQ-UHFFFAOYSA-N

SMILES

O(CC(CCN1C=2N=C(NC(=O)C2N=C1)N)COC(=O)C)C(=O)C

ChEBI Ontology
Outgoing	6-oxo-famciclovir (CHEBI:196591) is a purines (CHEBI:26401)

IUPAC Name

[2-(acetyloxymethyl)-4-(2-amino-6-oxo-1H-purin-9-yl)butyl] acetate