9-METHYLGUANINE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H7N5O
Molecular Weight	165.1527
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1C=NC2=C1N=C(N)NC2=O

InChI

InChIKey=UUWJNBOCAPUTBK-UHFFFAOYSA-N

InChI=1S/C6H7N5O/c1-11-2-8-3-4(11)9-6(7)10-5(3)12/h2H,1H3,(H3,7,9,10,12)

HIDE SMILES / InChI

Molecular Formula	C6H7N5O
Molecular Weight	165.1527
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Structure-activity relationships for the binding of ligands to xanthine or guanine phosphoribosyl-transferase from Toxoplasma gondii.	1995 Nov 9	7503772
Ab initio molecular orbital evaluation of the hydrogen bond energy of base pairs formed between substituted 1-methylcytosine derivatives and 9-methylguanine.	2001	12836248
Overexpression of human O6-alkylguanine DNA alkyltransferase (AGT) prevents MNU induced lymphomas in heterozygous p53 deficient mice.	2001 Aug 30	11536039
Theoretical study of substitution effect of the hydrogen bond stability of 9-methylguanine derivatives and 1-methylcytosine.	2002	12903170
Association patterns of platinated purine nucleobases in metal-modified pairs and triples.	2002 Nov 18	12425619
Colorectal carcinogenesis: MSI-H versus MSI-L.	2004	15528785
Prereplicative purine methylation and postreplicative demethylation in each DNA duplication of the Escherichia coli replication cycle.	2004 Dec 3	15448156
[Effect of carboxylate and Na ions on the tautomeric status of 9-methylguanine].	2004 Sep-Oct	16100901
Theoretical study of the ground and excited states of 7-methyl guanine and 9-methyl guanine: comparison with experiment.	2006 Jul 14	16804604
Targeted brain tumor treatment-current perspectives.	2007	21901074
Dual mechanisms of DNA damage by MoCH(3)(eta(3)-allyl)(CO)(2)(phen) complexes.	2007 Nov 9	17927248
Bone marrow-derived cells exhibiting lung epithelial cell characteristics are enriched in vivo using methylguanine DNA methyltransferase-mediated drug resistance.	2008 Mar	18192231
Valence anions of 9-methylguanine-1-methylcytosine complexes. Computational and photoelectron spectroscopy studies.	2009 Feb 25	19170629
Expanding the pH range of metal-nucleobase complexes for acid-base chemistry: properties of bis(guanine) complexes of (bpy)Pt(II) with either two major or major and minor tautomers bonded simultaneously.	2009 Jun 15	19499954
Methylguanine DNA methyltransferase-mediated drug resistance-based selective enrichment and engraftment of transplanted stem cells in skeletal muscle.	2009 May	19415780
Interaction of host cellular proteins with components of the hepatitis delta virus.	2010 Jan	21994607
Energy barriers between H-bonded and stacked structures of 9-methyladenine...1-methylthymine and 9-methylguanine...1-methylcytosine complexes.	2010 Jan 21	20066299
The excited electronic states of adenine-guanine stacked dimers in aqueous solution: a PCM/TD-DFT study.	2010 May 21	20442950
Acetaldehyde adducts in alcoholic liver disease.	2010 May-Jun	20716942
Formation, repair, and genotoxic properties of bulky DNA adducts formed from tobacco-specific nitrosamines.	2010 Sep 5	20871819

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:57:50 GMT 2023` Edited by `admin` on `Sat Dec 16 01:57:50 GMT 2023`
Record UNII	397W61ZHWY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

9-METHYLGUANINE

Systematic Name

English

NSC-19065

Code

English

2-AMINO-1,9-DIHYDRO-9-METHYL-6H-PURIN-6-ONE

Systematic Name

English

Code System Code Type Description

FDA UNII

397W61ZHWY