Basic information
- Standard SMILES
COCCO[C@@H]1[C@H](CI)[C@@H](CO)O[C@H]1n1cc(C)c(=O)[nH]c1=O- InChIKey
QNGJDMKIFNRXGE-PRULPYPASA-N- Molecular formula
- C14H21IN2O6
- Average molar mass
- 440.23 g/mol
- Monoisotopic mass
- 440.04443
Names & identifiers
- Preferred name
- 3'-Deoxy-3'-(iodomethyl)-2'-O-(2-methoxyethyl)-5-methyluridine
- IUPAC
- 1-[(2R,3R,4R,5S)-5-(hydroxymethyl)-4-(iodomethyl)-3-(2-methoxyethoxy)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Names & synonyms
SCHEMBL1738406QNGJDMKIFNRXGE-PRULPYPASA-N3'-Deoxy-3'-(iodomethyl)-2'-O-(2-methoxyethyl)-5-methyluridine
Database identifiers
- PubChem CID
- 23518331
- Nikkaji
- J1.391.061H
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 97.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 486
Related reactions
9 records
Compound notes
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