AC1L88SS
[4,5-diacetyloxy-6-(4-methoxy-2-oxopyrimidin-1-yl)-3-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate
Also Known As: [4,5-diacetyloxy-6-(4-methoxy-2-oxopyrimidin-1-yl)-3-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate|[4,5-diacetoxy-6-(4-methoxy-2-oxo-pyrimidin-1-yl)-3-[3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl acetate|2-[(Acetyloxy)methyl]-6-{[4,5-bis(acetyloxy)-2-[(acetyloxy)methyl]-6-(4-methoxy-2-oxopyrimidin-1(2H)-yl)oxan-3-yl]oxy}oxane-3,4,5-triyl triacetate|Acetic acid 4-acetoxy-6-acetoxymethyl-2-(4-methoxy-2-oxo-2H-pyrimidin-1-yl)-5-(3,4,5-triacetoxy-6-acetoxymethyl-tetrahydro-pyran-2-yloxy)-tetrahydro-pyran-3-yl ester
| Molecular Formula | C31H40N2O19 |
|---|---|
| Molecular Weight | 744.22253 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 254.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 20 |
| Exact Mass | 744.22253 |
| Monoisotopic Mass | 744.22253 |
| Heavy Atoms | 52 |
| Complexity | 1460.0 |
Chemical Identifiers
| CAS Number | 4752-87-8 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)N2C=CC(=NC2=O)OC)OC(=O)C)OC(=O)C)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | DPSGZQDMGQZXGN-UHFFFAOYSA-N |
Product Overview
AC1L88SS (CAS 4752-87-8), with molecular formula C31H40N2O19 and molecular weight 744.22253 g/mol. IUPAC: [4,5-diacetyloxy-6-(4-methoxy-2-oxopyrimidin-1-yl)-3-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate.