AC1MHXVV
[(2R,3R,4R,5R)-5-(4-carbamothioyl-5-formamidoimidazol-1-yl)-3,4-diformyloxyoxolan-2-yl]methyl formate
Also Known As: 1H-Imidazole-4-carbothioamide, 5-(formylamino)-1-(2,3,5-tri-O-formyl-beta-D-ribofuranosyl)-|[(2R,3R,4R,5R)-5-(4-carbamothioyl-5-formamidoimidazol-1-yl)-3,4-diformyloxyoxolan-2-yl]methyl formate|Formamide, N-[4-(aminothioxomethyl)-1-(2,3,5-tri-O-formyl-.beta|5-Formamido-1-beta-D-ribofuranosylthioimidazole-4-carboxamide 2',3',5'-triformate
| Molecular Formula | C13H14N4O8S |
|---|---|
| Molecular Weight | 386.05322 g/mol |
| LogP | -1.7608 |
| Topological Polar Surface Area | 161.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 386.05322 |
| Monoisotopic Mass | 386.05322 |
| Heavy Atoms | 26 |
| Complexity | 695.68396 |
Chemical Identifiers
| CAS Number | 27115-65-7 |
|---|---|
| SMILES | C1=NC(=C(N1[C@H]2[C@@H]([C@@H]([C@H](O2)COC=O)OC=O)OC=O)NC=O)C(=S)N |
Product Overview
AC1MHXVV (CAS 27115-65-7), with molecular formula C13H14N4O8S and molecular weight 386.05322 g/mol. IUPAC: [(2R,3R,4R,5R)-5-(4-carbamothioyl-5-formamidoimidazol-1-yl)-3,4-diformyloxyoxolan-2-yl]methyl formate.
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