1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methylpyrimidine-2,4-dione
AlkaPlorer ID: AK006727
Synonym: "3-methyl-2'-deoxyuridine", '1-(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione', "3-Methyl-2'-deoxyuridine", '24514-32-7'
IUPAC Name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methylpyrimidine-2,4-dione
Structure
SMILES: CN1C(=O)C=CN([C@H]2C[C@H](O)[C@@H](CO)O2)C1=O
InChI: InChI=1S/C10H14N2O5/c1-11-8(15)2-3-12(10(11)16)9-4-6(14)7(5-13)17-9/h2-3,6-7,9,13-14H,4-5H2,1H3/t6-,7+,9+/m0/s1
InChIKey: ZTSLSWUGHMGGCM-LKEWCRSYSA-N
Reference
Deoxyuridines from the Marine Sponge Associated Actinomycete Streptomyces microflavus
PubChem CID: 13845047
LOTUS: LTS0000150
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces microflavus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 242.231
TPSA？: 93.69
MolLogP？: -1.8122999999999991
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Cavia porcellus | Ileum | Activity | 0.0 | % | 10.1021/np50060a041 |
| Cavia porcellus | Ileum | Inhibition | 0.0 | % | 10.1021/np50060a041 |
| Rattus norvegicus | Thymidine kinase | Inhibition | 62.0 | % | 10.1021/jm00348a007 |
| Rattus norvegicus | Thymidine kinase 2 | Inhibition | 4.0 | % | 10.1021/jm00348a007 |