e7dGMP – 7-ethyl-2'-deoxyguanosine monophosphate

Name
WID e7dGMP View in model
Name 7-ethyl-2'-deoxyguanosine monophosphate View in model
Traditional name 2-amino-7-ethyl-9-{4-hydroxy-5-[(phosphonatooxy)methyl]oxolan-2-yl}-6-oxo-3H-1,3,7,9$l^{5}-purin-9-ylium
IUPAC name 2-amino-7-ethyl-9-{4-hydroxy-5-[(phosphonatooxy)methyl]oxolan-2-yl}-6-oxo-6,7-dihydro-3H-1,3,7,9$l^{5}-purin-9-ylium
 
Classification
Type modified_deoxyribonucleotide_monophosphate_ethylation View in model
 
Structure
Empirical formula (pH 7.5) H17C12N5O7P1
SMILES (pH 7.5) CCN1C=[N+](C2CC(O)C(COP([O-])([O-])=O)O2)C2=C1C(=O)N=C(N)N2
Charge (pH 7.5) -1
Is hydrophobic False View in model
Molecular weight (Da) 374.27 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
291.65
logP -5.07
logD (pH 7.5) -7.59
 
Function
Reaction participant 5'-nucleotidase (7-ethyl-2'-deoxyguanosine monophosphate)
[c]: e7dGMP + H2Oe7dG + PI
View in model
 
Metadata
Created 2012-10-01 15:06:56
Last updated 2012-10-01 15:12:07