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Epoxudine

HCID 1814
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Basic information

Standard SMILES
CCc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O
InChIKey
XACKNLSZYYIACO-UHFFFAOYSA-N
Molecular formula
C11H16N2O5
Average molar mass
256.25 g/mol
Monoisotopic mass
256.10592162

Names & identifiers

Preferred name
Epoxudine
IUPAC
5-ethyl-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione

Names & synonyms

EUDREpoxudine5-ethyl-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-dihydropyrimidine-2,4-d ione1-(2-deoxypentofuranosyl)-5-ethylpyrimidine-2,4(1h,3h)-dioneEdurid (Salt/Mix).beta.-5-EthyldeoxyuridineTimTec1_004024SCHEMBL65580MLS001360450DTXSID70860153.beta.-5-Ethyl-2'-deoxyuridineXACKNLSZYYIACO-UHFFFAOYSA-N
Show more names
HMS1545G20HMS3056J10HMS3369L225-Ethyl-2'-deoxyuridine ; EdoxudineAKOS024282522SMR001223874ST0569295-Ethyl-1-(2'-Deoxy-.beta.-D-ribofuranosyl)uracil

Database identifiers

PubChem CID
1814
DTXSID
DTXSID70860153

Properties

Computed structural properties

XLogP
-0.7
Topological polar surface area
99.1 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
395

Experimental & physicochemical properties

Solubility>38.4 [ug/mL] (The mean of the results at pH 7.4)

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Related reactions

1 records
New reaction record
HRID 681043 reaction equation
HRID 681043As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

Compound notes

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