CHEBI:134512 - adefovir(1−)

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ChEBI Name adefovir(1−) ChEBI ID CHEBI:134512 ChEBI ASCII Name adefovir(1-) Definition A organophosphonate oxoanion obtained by removal of a proton from the phosphonate group of adefovir, a nucleoside reverse transcriptase inhibitor. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H11N5O4P Net Charge -1 Average Mass 272.178 Monoisotopic Mass 272.05541 InChI InChI=1S/C8H12N5O4P/c9-7-6-8(11-3-10-7)13(4-12-6)1-2-17-5-18(14,15)16/h3-4H,1-2,5H2,(H2,9,10,11)(H2,14,15,16)/p-1 InChIKey SUPKOOSCJHTBAH-UHFFFAOYSA-M SMILES C1=2C(N=CN1CCOCP(O)([O-])=O)=C(N=CN2)N ChEBI Ontology Outgoing adefovir(1−) (CHEBI:134512) is a organophosphonate oxoanion (CHEBI:59635) adefovir(1−) (CHEBI:134512) is conjugate base of adefovir (CHEBI:2469) Incoming adefovir (CHEBI:2469) is conjugate acid of adefovir(1−) (CHEBI:134512) IUPAC Name hydrogen {[2-(6-amino-9H-purin-9-yl)ethoxy]methyl}phosphonate Synonym Source adefovir UniProt Citation Type Source 15914676 PubMed citation SUBMITTER Last Modified 24 October 2018