Aranotine
(16-hydroxy-2,13-dioxo-8,19-dioxa-23,24-dithia-3,14-diazahexacyclo[10.10.2.01,14.03,12.04,10.015,21]tetracosa-6,9,17,20-tetraen-5-yl) acetate
Also Known As: Aranotine, Ariotin, ARANOTIN, Aranotinum, Aranotina, Aranotin [USAN:INN], Aranotine [INN-French], Aranotinum [INN-Latin], Aranotina [INN-Spanish], Lilly 53185, Aranotin (USAN/INN), Antibiotic A 21101-IL, A-21101-IL, BRN 3042102, A 21101-IL
| Molecular Formula | C20H18N2O7S2 |
|---|---|
| Molecular Weight | 462.05554 g/mol |
| LogP | 1.14 |
| Topological Polar Surface Area | 105.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 1 |
| Exact Mass | 462.05554 |
| Heavy Atoms | 31 |
| Complexity | 1038 |
Chemical Identifiers
| CAS Number | 19885-51-9 |
|---|---|
| SMILES | CC(=O)OC1C=COC=C2C1N3C(=O)C45CC6=COC=CC(C6N4C(=O)C3(C2)SS5)O |
Product Overview
Aranotine (CAS 19885-51-9), with molecular formula C20H18N2O7S2 and molecular weight 462.05554 g/mol. IUPAC: (16-hydroxy-2,13-dioxo-8,19-dioxa-23,24-dithia-3,14-diazahexacyclo[10.10.2.01,14.03,12.04,10.015,21]tetracosa-6,9,17,20-tetraen-5-yl) acetate.
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