ho5ho6THY – 5-hydroxy-6-hydroxythymine
| Name | ||
|---|---|---|
| WID | ho5ho6THY |
|
| Name | 5-hydroxy-6-hydroxythymine |
|
| Traditional name | 5-hydroxy-5-methyl-1,3-diazinane-2,4-dione | |
| IUPAC name | 5-hydroxy-5-methyl-1,3-diazinane-2,4-dione | |
| Cross references | CAS: 1123-21-3, PubChem: 24589118 | |
| Classification | ||
| Type | modified_nucleobase |
|
| Structure | ||
| Empirical formula (pH 7.5) | H8C5N2O3 | |
| SMILES (pH 7.5) | CC1(CNC(=O)NC1=O)O | |
| Charge (pH 7.5) | 0 | |
| Is hydrophobic | False |
|
| Molecular weight (Da) | 144.13 |
|
| van der Waals volume (pH 7.5; Å3 molecule‑1) |
121.15 | |
| pI | 2.53 | |
| logP | -1.50 | |
| logD (pH 7.5) | -1.50 | |
| Function | ||
| Reaction participant | DNA radiation (gamma-ray) induced base oxidation (thymine ==> 5-hydroxy-6-hydroxythymine; hydroxyl radical) gamma_radiation[e] + H[c] + hydroxyl_radical[c] + THY[c] ⇒ ho5ho6THY[c] |
|
| Metadata | ||
| Created | 2012-10-01 15:07:01 | |
| Last updated | 2012-10-01 15:12:16 | |
