hm3CSN – 3'-hydroxymethylcytosine

Name
WID hm3CSN View in model
Name 3'-hydroxymethylcytosine View in model
Traditional name 4-[(hydroxymethyl)amino]-1H-pyrimidin-2-one
IUPAC name 4-[(hydroxymethyl)amino]-1,2-dihydropyrimidin-2-one
Cross references PubChem: 91848467
 
Classification
Type modified_nucleobase View in model
 
Structure
Empirical formula (pH 7.5) H7C5N3O2
SMILES (pH 7.5) C(NC1=NC(=O)NC=C1)O
Charge (pH 7.5) 0
Is hydrophobic False View in model
Molecular weight (Da) 141.13 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
118.12
pI 12.16
logP -1.54
logD (pH 7.5) -1.54
 
Function
Reaction participant DNA radiation (gamma-ray) induced base oxidation (3-methylcytosine ==> 3'-hydroxymethylcytosine; hydroxyl radical)
gamma_radiation[e] + hydroxyl_radical[c] + m3CSN[c] ⇒ H[c] + hm3CSN[c]
View in model
 
Metadata
Created 2012-10-01 15:07:00
Last updated 2012-10-01 15:12:15