epsilonN23GN – N2,3-etheno-guanine
Name | ||
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WID | epsilonN23GN |
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Name | N2,3-etheno-guanine |
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Traditional name | 1H,5H-imidazo[2,1-b]purin-4-one | |
IUPAC name | 1H,4H,5H-imidazo[2,1-b]purin-4-one | |
Cross references | PubChem: 24520287, CAS: 56287-13-9 | |
Classification | ||
Type | modified_nucleobase |
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Structure | ||
Empirical formula (pH 7.5) | H5C7N5O1 | |
SMILES (pH 7.5) | O=C1NC2=NC=CN2C2=C1N=CN2 | |
Charge (pH 7.5) | 0 | |
Is hydrophobic | False |
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Molecular weight (Da) | 175.15 |
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van der Waals volume (pH 7.5; Å3 molecule‑1) |
131.23 | |
pI | 5.97 | |
logP | -0.970 | |
logD (pH 7.5) | -0.970 | |
Function | ||
Reaction participant | DNA base alkylation (guanine ==> N2,3-etheno-guanine; chloroethylene oxide) [c]: chloroethylene_oxide + GN ⇒ CL + epsilonN23GN + (2) H + OH |
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Metadata | ||
Created | 2012-10-01 15:06:57 | |
Last updated | 2012-10-01 15:12:08 |