Isodialuric acid
Basic information
- CAS
102636-37-3- Standard SMILES
O=c1[nH]c(O)c(O)c(=O)[nH]1- InChIKey
YFQOVSGFCVQZSW-UHFFFAOYSA-N- Molecular formula
- C4H4N2O4
- Average molar mass
- 144.09 g/mol
- Monoisotopic mass
- 144.01710661
Overview
5,6-dihydroxyuracil is a nucleobase analogue that is uracil substituted at positions 5 and 6 by hydroxy groups. It has a role as a Mycoplasma genitalium metabolite. It is a pyrimidone, a hydroxypyrimidine and a nucleobase analogue. It is functionally related to a uracil.
Names & identifiers
- Preferred name
- Isodialuric acid
- IUPAC
- 5,6-dihydroxy-1H-pyrimidine-2,4-dione
- English name
- isodialuric acid
- Molecular formula
- C4H4N2O4
- Molecular weight
- 144.08556
Names & synonyms
5,6-DihydroxyuracilIsodialuric acid102636-37-35,6-dihydroxy-2,4(1H,3H)pyrimidinedioneCHEBI:132197RefChem:1492765,6-dihydroxy-1H-pyrimidine-2,4-dioneEINECS 207-145-0BRN 01351305,6-Dihydroxy-2,4(1H,3H)-pyrimidinedioneSCHEMBL48171SCHEMBL133285
Show more names
Barbituric Acid Impurity 27
5,6-dihydroxy-1,2,3,4-tetrahydropyrimidine-2,4-dione5,6-dihydroxypyrimidine-2,4(1H,3H)-dione2,4(1H,3H)-Pyrimidinedione, 5,6-dihydroxy-Q1208512
Database identifiers
- CAS
102636-37-3、444-15-5- PubChem CID
- 67956
- ChEBI
CHEBI:132197- Nikkaji
- J648.943E
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 231
Chemistry & industry
Additional notes
DefinitionChEBI: A nucleobase analogue that is uracil substituted at positions 5 and 6 by hydroxy groups.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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