AC1L8A05
[5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate
Also Known As: [5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate|.alpha.-D-threo-Hex-2-enopyranoside, methyl 2-(acetylamino)-2,3,4-trideoxy-4-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)-, 6-acetate|Methyl 6-O-acetyl-2,3,4-trideoxy-4-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-2-[(1-hydroxyethylidene)amino]hex-2-enopyranoside
| Molecular Formula | C18H23N5O7 |
|---|---|
| Molecular Weight | 421.15976 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.15976 |
| Monoisotopic Mass | 421.15976 |
| Heavy Atoms | 30 |
| Complexity | 772.0 |
Chemical Identifiers
| CAS Number | 70800-68-9 |
|---|---|
| SMILES | CC(=O)NC1=CC(C(OC1OC)COC(=O)C)N2C=NC3=C2C(=O)N(C(=O)N3C)C |
| InChIKey | AAMHLDYPMSIFIW-UHFFFAOYSA-N |
Product Overview
AC1L8A05 (CAS 70800-68-9), with molecular formula C18H23N5O7 and molecular weight 421.15976 g/mol. IUPAC: [5-acetamido-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-6-methoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate.
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