(3,5-Dibenzoyloxy-4-imidazol-1-ylsulfonyloxyoxolan-2-yl)methyl benzoate
Basic information
- CAS
97614-42-1- Standard SMILES
O=C(OCC1OC(OC(=O)c2ccccc2)C(OS(=O)(=O)n2ccnc2)C1OC(=O)c1ccccc1)c1ccccc1- InChIKey
DHQMZEQWPVIFFR-UHFFFAOYSA-N- Molecular formula
- C29H24N2O10S
- Average molar mass
- 592.6 g/mol
- Monoisotopic mass
- 592.11516614
Names & identifiers
- Preferred name
- (3,5-Dibenzoyloxy-4-imidazol-1-ylsulfonyloxyoxolan-2-yl)methyl benzoate
- IUPAC
- (3,5-dibenzoyloxy-4-imidazol-1-ylsulfonyloxyoxolan-2-yl)methyl benzoate
- English name
- 2-(1'-Imidazoylsulfonyl)-1,3,5-tri-O-benzoyl-alpha-D-ribofuranose
- Molecular formula
- C29H24N2O10S
- Molecular weight
- 592.57
Names & synonyms
FAU PRECURSORC29H24N2O10SNSC706201(3,5-dibenzoyloxy-4-imidazol-1-ylsulfonyloxyoxolan-2-yl)methyl benzoateSCHEMBL14387913DTXSID50913797(2R,3R,4R,5R)-5-(benzoyloxy)-2-[(benzoyloxy)methyl]-4-[(1H-imidazole-1-sulfonyl)oxy]oxolan-3-yl benzoateMB44535NSC-706201(3,5-dibenzoyloxy-4-imidazol-1-ylsulfonyloxy-tetrahydrofuran-2-yl)methyl benzoate1,3,5-Tri-O-benzoyl-2-O-(1H-imidazole-1-sulfonyl)pentofuranose1,3,5-Tri-O-benzoyl-2-O-(1H-imidazol-1-ylsulfonyl)-alpha-D-ribofuranose
Show more names
2-(1'-imidazoylsulfonyl)-1,3,5-tri-o-benzoyl-α-d-ribofuranose1,2,5-Tri-O-benzoyl-2-(1'-imidazoylsulfonyl)-a-D-ribofuranose2-(1'-Imidazoylsulfonyl)-1,2,5-tri-O-benzoyl-α-D-ribofuranose2-O-(imidazolylsulfonyl)-1,3,5-tri-O-benzoyl-α-D-ribofuranose1,3,5-Tri-O-benzoyl-2-O-(1'-imidazoylsulfonyl)-a-D-ribofuranoseα-D-Ribofuranose, 1,3,5-tribenzoate 2-(1H-imidazole-1-sulfonate)a-D-Ribofuranose, 1,3,5-tribenzoate 2-(1H-imidazole-1-sulfonate)2-(1'-imidazoylsulfonyl)-1,3,5-tri-o-benzoyl-alpha-d-ribofuranose
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 158 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 13
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 1,030
Chemistry & industry
Applications
Uses1,3,5-Tri-O-benzoyl-2-O-(1H-imidazol-1-ylsulfonyl)-alpha-D-ribofuranose is used in the preparation of clofarabine (nucleoside analog) for cancer treatment
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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