cyclobutane_THYTHY – cyclobutane thymine dimer
| Name | ||
|---|---|---|
| WID | cyclobutane_THYTHY |
|
| Name | cyclobutane thymine dimer |
|
| Traditional name | 4a,4b-dimethyl-hexahydro-1,3,6,8-tetraazabiphenylene-2,4,5,7-tetrone | |
| IUPAC name | 4a,4b-dimethyl-dodecahydro-1,3,6,8-tetraazabiphenylene-2,4,5,7-tetrone | |
| Cross references | PubChem: 24610583 | |
| Classification | ||
| Type | modified_nucleobase |
|
| Structure | ||
| Empirical formula (pH 7.5) | H12C10N4O4 | |
| SMILES (pH 7.5) | CC13C(C2C1(C(=O)NC(=O)N2)C)NC(=O)NC3=O | |
| Charge (pH 7.5) | 0 | |
| Is hydrophobic | False |
|
| Molecular weight (Da) | 252.23 |
|
| van der Waals volume (pH 7.5; Å3 molecule‑1) |
202.57 | |
| logP | -1.63 | |
| logD (pH 7.5) | -1.66 | |
| Function | ||
| Reaction participant | DNA photodimerization (2'-deoxythymidine-p-2'-deoxythymidine ==> cyclobutane 2'-deoxythymidine dimer; UV-B) (2) THY[c] + UVB_radiation[e] ⇒ cyclobutane_THYTHY[c] |
|
| Metadata | ||
| Created | 2012-10-01 15:06:53 | |
| Last updated | 2012-10-01 15:11:59 | |
