Basic information
- CAS
142506-00-1- Standard SMILES
CP(=O)(O)OC[C@H]1O[C@@H](n2cc(F)c(=O)[nH]c2=O)[C@H]2O[C@H]21- InChIKey
MLBYBXNZBRALOB-UTSKPXGSSA-N- Molecular formula
- C10H12FN2O7P
- Average molar mass
- 322.18 g/mol
- Monoisotopic mass
- 322.03661589
Names & identifiers
- Preferred name
- LaFU-MeP
- IUPAC
- [(1S,2R,4R,5S)-4-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methoxy-methylphosphinic acid
Names & synonyms
LaFU-MeP142506-00-12,4(1H,3H)-Pyrimidinedione, 1-(2,3-anhydro-5-O-(hydroxymethylphosphinyl)-beta-D-lyxofuranosyl)-5-fluoro-DTXSID70931498[(1S,2R,4R,5S)-4-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]methoxy-methyl-phosphinic acid1-{2,3-Anhydro-5-O-[hydroxy(methyl)phosphoryl]-beta-D-lyxofuranosyl}-5-fluoro-4-hydroxypyrimidin-2(1H)-one1-{2,3-Anhydro-5-O-[hydroxy(methyl)phosphoryl]pentofuranosyl}-5-fluoro-4-hydroxypyrimidin-2(1H)-one2,4(1H,3H)-Pyrimidinedione, 1-[2,3-anhydro-5-O-(hydroxymethylphosphinyl)-.beta.-D-lyxofuranosyl]-5-fluoro-
Database identifiers
- CAS
142506-00-1- PubChem CID
- 3000408
- DTXSID
DTXSID70931498
Properties
Computed structural properties
- XLogP
- -2.2
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 582
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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