PRF

7-DEAZA-7-AMINOMETHYL-GUANINE

Created:	2000-02-14
Last modified:	2024-09-27

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	23
Aromatic Bond Count	5

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Chemical Component Summary
Name	7-DEAZA-7-AMINOMETHYL-GUANINE
Systematic Name (OpenEye OEToolkits)	2-amino-5-(aminomethyl)-3,7-dihydropyrrolo[3,2-e]pyrimidin-4-one
Formula	C₇ H₉ N₅ O
Molecular Weight	179.179
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C1c2c(cnc2N=C(N1)N)CN
SMILES	CACTVS	3.341	NCc1c[nH]c2N=C(N)NC(=O)c12
SMILES	OpenEye OEToolkits	1.5.0	c1c(c2c([nH]1)N=C(NC2=O)N)CN
Canonical SMILES	CACTVS	3.341	NCc1c[nH]c2N=C(N)NC(=O)c12
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1c(c2c([nH]1)N=C(NC2=O)N)CN
InChI	InChI	1.03	InChI=1S/C7H9N5O/c8-1-3-2-10-5-4(3)6(13)12-7(9)11-5/h2H,1,8H2,(H4,9,10,11,12,13)
InChIKey	InChI	1.03	MEYMBLGOKYDGLZ-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB03304
Name	7-Deaza-7-Aminomethyl-Guanine
Groups	experimental
Synonyms	7-Deaza-7-Aminomethyl-Guanine

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Queuine tRNA-ribosyltransferase	MVEATAQETDRPRFSFSIAAREGKARTGTIEMKRGVIRTPAFMPVGTAAT...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682