(R)-1-(5-hydroxyhexyl)-3,7-dimethyluric acid
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Basic information
- Standard SMILES
C[C@@H](O)CCCCn1c(=O)c2c([nH]c(=O)n2C)n(C)c1=O- InChIKey
ATKWCCRHDAWKTH-MRVPVSSYSA-N- Molecular formula
- C13H20N4O4
- Average molar mass
- 296.32 g/mol
Names & identifiers
- Preferred name
- (R)-1-(5-hydroxyhexyl)-3,7-dimethyluric acid
- IUPAC
- 1-[(5R)-5-hydroxyhexyl]-3,7-dimethyl-9H-purine-2,6,8-trione
Names & synonyms
(R)-1-(5-hydroxyhexyl)-3,7-dimethyluric acidSCHEMBL6349596ATKWCCRHDAWKTH-MRVPVSSYSA-N(R)-1(5-hydroxyhexyl)-3,7-dimethyluric acid1-[(5R)-5-hydroxyhexyl]-3,7-dimethyl-9H-purine-2,6,8-trione
Database identifiers
- PubChem CID
- 11601789
- Nikkaji
- J1.632.601A
Properties
Computed structural propertiesFilling in
- XLogP
- 0.4
- Topological polar surface area
- 93.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 516
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Related reactions
2 records
Compound notes
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