Basic information
- Standard SMILES
CCCCCCC(=O)OCn1c(=O)c(F)cn([C@H]2C[C@H](O)[C@@H](CO)O2)c1=O- InChIKey
FFEIJCXQABVRGG-BFHYXJOUSA-N- Molecular formula
- C17H25FN2O7
- Average molar mass
- 388.4 g/mol
- Monoisotopic mass
- 388.1645793
Names & identifiers
- Preferred name
- 3-n-Heptanoyloxymethyl-2'-deoxy-5-fluorouridine
- IUPAC
- [5-fluoro-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,6-dioxopyrimidin-1-yl]methyl heptanoate
Names & synonyms
SCHEMBL8908690FFEIJCXQABVRGG-BFHYXJOUSA-N3-n-heptanoyloxymethyl-2'-deoxy-5-fluorouridine
Database identifiers
- PubChem CID
- 53796147
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 598
Related reactions
1 records
Compound notes
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