SCHEMBL1411935

AlkaPlorer ID: AK016085

Synonym: 'SCHEMBL1411935', '3-acetyl-5-methyl-2′-deoxyuridine'

IUPAC Name: 3-acetyl-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Structure

SMILES: CC(=O)N1C(=O)C(C)=CN([C@H]2CC(O)[C@@H](CO)O2)C1=O

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InChI: InChI=1S/C12H16N2O6/c1-6-4-13(10-3-8(17)9(5-15)20-10)12(19)14(7(2)16)11(6)18/h4,8-10,15,17H,3,5H2,1-2H3/t8?,9-,10-/m1/s1

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InChIKey: DOYZPOPPDQRFPK-VXRWAFEHSA-N

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Properties Information

Molecule Weight: 284.26800000000003

TPSA: 110.76000000000002

MolLogP: -1.38078

Number of H-Donors: 2

Number of H-Acceptors: 8

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information