Name: Name:Acetic acid,2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-
Brand: Angene
SKU: AG0058PL
Rating: 90 (10 reviews)

Catalog Number:

AG0058PL

Chemical Name:

Acetic acid,2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-

CAS Number:

80685-22-9

Molecular Formula:

C8H9N5O4

Molecular Weight:

239.1882

MDL Number:

MFCD31568197

IUPAC Name:

2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]acetic acid

InChI:

InChI=1S/C8H9N5O4/c9-8-11-6-5(7(16)12-8)10-2-13(6)3-17-1-4(14)15/h2H,1,3H2,(H,14,15)(H3,9,11,12,16)

InChI Key:

MICNQLKUSOVNNG-UHFFFAOYSA-N

SMILES:

OC(=O)COCn1cnc2c1nc(N)[nH]c2=O

UNII:

N28227W35C

Complexity:

371

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

1

Defined Atom Stereocenter Count:

0

Defined Bond Stereocenter Count:

0

Exact Mass:

239.065g/mol

Formal Charge:

0

Heavy Atom Count:

17

Hydrogen Bond Acceptor Count:

6

Hydrogen Bond Donor Count:

3

Isotope Atom Count:

0

Molecular Weight:

239.191g/mol

Monoisotopic Mass:

239.065g/mol

Rotatable Bond Count:

4

Topological Polar Surface Area:

132A^2

Undefined Atom Stereocenter Count:

0

Undefined Bond Stereocenter Count:

0

XLogP3:

-1.6

Title	Journal
Acyclovir-induced nephrotoxicity: the role of the acyclovir aldehyde metabolite.	Translational research : the journal of laboratory and clinical medicine 20111101
Biotransformation of the antiviral drugs acyclovir and penciclovir in activated sludge treatment.	Environmental science & technology 20110401
Acyclovir nephrotoxicity: a case report highlighting the importance of prevention, detection, and treatment of acyclovir-induced nephropathy.	Case reports in medicine 20100101
Influence of ALDH2 genetic polymorphisms on aciclovir pharmacokinetics following oral administration of valaciclovir in Japanese end-stage renal disease patients.	Drug metabolism and pharmacokinetics 20080101
Acyclovir-induced neuropsychosis successfully recovered after immediate hemodialysis in an end-stage renal disease patient.	International journal of dermatology 20070801
Development, evaluation and application of an isocratic high-performance liquid chromatography (HPLC) assay for the simultaneous determination of aciclovir and its metabolite 9-carboxymethoxymethylguanine in human serum and cerebrospinal fluid.	International journal of antimicrobial agents 20070701
[Risk of CNS adverse effects of aciclovir and valaciclovir. Watch the renal function in treatment of herpes simplex and herpes zoster].	Lakartidningen 20070601
The aciclovir metabolite CMMG is detectable in the CSF of subjects with neuropsychiatric symptoms during aciclovir and valaciclovir treatment.	The Journal of antimicrobial chemotherapy 20060501
Aciclovir and valaciclovir neurotoxicity in patients with renal failure.	Nephrology, dialysis, transplantation : official publication of the European Dialysis and Transplant Association - European Renal Association 20031201
High serum concentrations of the acyclovir main metabolite 9-carboxymethoxymethylguanine in renal failure patients with acyclovir-related neuropsychiatric side effects: an observational study.	Nephrology, dialysis, transplantation : official publication of the European Dialysis and Transplant Association - European Renal Association 20030601