1-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Details

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Internal ID 97284d76-6573-4297-b7c4-3745e32c4a6e
Taxonomy Nucleosides, nucleotides, and analogues > Pyrimidine nucleosides
IUPAC Name 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C10H14N2O6/c1-4-2-12(10(17)11-8(4)16)9-7(15)6(14)5(3-13)18-9/h2,5-7,9,13-15H,3H2,1H3,(H,11,16,17)
InChI Key DWRXFEITVBNRMK-UHFFFAOYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C10H14N2O6
Molecular Weight 258.23 g/mol
Exact Mass 258.08518617 g/mol
Topological Polar Surface Area (TPSA) 119.00 Ų
XlogP -1.60

Synonyms

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1-(-D-Xylofuranosyl)-5-methyluracil
5-METHYL-[2'-13C]URIDINE
5-METHYL-[3'-13C]URIDINE
5-METHYL-[5'-13C]URIDINE
Uridine-1',2',3',4',5'-13C5, 5-methyl- (9CI)
arabinofuranosylthymine
Thymine-beta-D -arabinofuranoside
1-.beta.-D-Arabinofuranosylthymine
MFCD00006535
NSC-68929
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 1-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL4016 P42262 Glutamate receptor ionotropic, AMPA 2 94.80% 86.92%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.56% 96.09%
CHEMBL2581 P07339 Cathepsin D 91.69% 98.95%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.32% 95.56%
CHEMBL3401 O75469 Pregnane X receptor 89.18% 94.73%
CHEMBL220 P22303 Acetylcholinesterase 84.90% 94.45%
CHEMBL1806 P11388 DNA topoisomerase II alpha 83.23% 89.00%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 82.77% 94.00%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 82.43% 99.23%
CHEMBL253 P34972 Cannabinoid CB2 receptor 80.24% 97.25%
CHEMBL3137262 O60341 LSD1/CoREST complex 80.01% 97.09%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 249989
LOTUS LTS0207204
wikiData Q104990716