Amrubicin
(7S,9S)-9-acetyl-9-amino-7-[(2S,4S,5R)-4,5-dihydroxyoxan-2-yl]oxy-6,11-dihydroxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: Amrubicin|amrubicina|amrubicine|amrubicinum|Amrubicin [INN]|Amurubicin|Amrubicin Api|Amrubicin HCl|Amrubicin maleate|(2R)-Amrubicin|Amrubicin [USAN:INN]|Amrubicin hydrochloride|Amrubicin(SM-5887)|AMRUBICIN [MI]|Amrubicin (USAN/INN)|AMRUBICIN [USAN]|AMRUBICIN [MART.]|AMRUBICIN [WHO-DD]|EX-A161|HY-B0067|SM-5887|3441AH|CS-2836|NCGC00390270-01
| Molecular Formula | C25H25NO9 |
|---|---|
| Molecular Weight | 483.15292 g/mol |
| LogP | 0.6318 |
| Topological Polar Surface Area | 176.61 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 483.15292 |
| Monoisotopic Mass | 483.15292 |
| Heavy Atoms | 35 |
| Complexity | 1272.0692 |
Chemical Identifiers
| CAS Number | 913076-54-7 |
|---|---|
| SMILES | CC(=O)[C@]1(C[C@@H](C2=C(C1)C(=C3C(=C2O)C(=O)C4=CC=CC=C4C3=O)O)O[C@H]5C[C@@H]([C@@H](CO5)O)O)N |
Product Overview
Amrubicin (CAS 913076-54-7), with molecular formula C25H25NO9 and molecular weight 483.15292 g/mol. IUPAC: (7S,9S)-9-acetyl-9-amino-7-[(2S,4S,5R)-4,5-dihydroxyoxan-2-yl]oxy-6,11-dihydroxy-8,10-dihydro-7H-tetracene-5,12-dione.
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