Adefovir

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Systematic / IUPAC Name: {[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl}phosphonic acid

ID: Reference122

Other Names: Phosphonic acid, [[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]-;
2-(6-Amino-9H-purin-9-yl)ethoxy]methylphosphonic acid;
9-[2-(Phosphonomethoxy)ethyl]purine-6-ylamine;
9-{2-[Phosphonomethoxy]ethyl}adenine;
N-(2-Phophonomethoxyethyl-2,6-diaminopurine) ; more

Formula: C8H12N5O4P

Class: Therapeutics/Prescription Drugs

Spectral Data

Adefovir mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 85
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/5/2014 9:40:29 AM
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Identificators

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)
InChI Key SUPKOOSCJHTBAH-UHFFFAOYSA-N
Canonical SMILES
CAS 106941257
Splash
Other Names Phosphonic acid, [[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]-;
2-(6-Amino-9H-purin-9-yl)ethoxy]methylphosphonic acid;
9-[2-(Phosphonomethoxy)ethyl]purine-6-ylamine;
9-{2-[Phosphonomethoxy]ethyl}adenine;
N-(2-Phophonomethoxyethyl-2,6-diaminopurine);
N9-[2-(Phosphonomethoxy)ethyl]adenine;
Phosphonic acid, ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)-;
Phosphonic acid, p-[[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]-;
9-PMEA;
PMEA

In Other Databases

ChEMBL CHEMBL484
KEGG C11277; D02768
PubChem 60172
Wikipedia Adefovir
ChemIDPlus 106941257
ChemSpider 54252; 21234769