CAS Registry Number®
106941-25-7
CAS Name
Adefovir
Molecular Formula
C8H12N5O4P
Molecular Mass
273.19
Compound Properties
-
Melting Point (1)
301 °C
Source(s)
- (1) Holy, Antonin; Journal of Medicinal Chemistry, (1999), 42(12), 2064-2086, CAplus
Other Names and Identifiers
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)
InChIKey
InChIKey=SUPKOOSCJHTBAH-UHFFFAOYSA-N
SMILES
C(COCP(=O)(O)O)N1C=2C(N=C1)=C(N)N=CN2
Canonical SMILES
O=P(O)(O)COCCN1C=NC=2C(=NC=NC21)N
Other Names for this Substance
- Phosphonic acid, P-[[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]-
- Phosphonic acid, [[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]-
- P-[[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl]phosphonic acid
- 9-(2-Phosphonylmethoxyethyl)adenine
- PMEA
- 9-[2-(Phosphonomethoxy)ethyl]adenine
- GS 0393
- Adefovir
- ((2-(6-Amino-9H-purin-9-yl)ethoxy)methyl)phosphonicacid
- [[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl]phosphonic acid
- 2-(6-Aminopurin-9-yl)ethoxymethylphosphonic acid
