Dirithromycin EP Impurity A (Erythromycylamine)

Chemical Information
(9S)-erythromycyclamine is a macrolide antibiotic that is erythromycin A in which the ketone group has been converted into the corresponding imine and then reduced to give the corresponding amino compound (the 9S diastereoisomer).
| CAS Number | 26116-56-3 |
| PubChem CID | 83952 |
| IUPAC Name | (3R,4S,5S,6R,7R,9R,10S,11S,12R,13S,14R)-10-amino-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecan-2-one |
| Molecular Formula | C37H70N2O12 |
| Molecular Weight | 735.0 |
| XLogP | 3.5 |
| Topological Polar Surface Area | 203 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 7 |
| Heavy Atom Count | 51 |
| Formal Charge | 0 |
| Complexity | 1140 |
| Property | Value |
|---|---|
| Molecular Weight | 735.0 |
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 7 |
| Exact Mass | 734.49287567 |
| Monoisotopic Mass | 734.49287567 |
| Topological Polar Surface Area | 203 Ų |
| Heavy Atom Count | 51 |
| Formal Charge | 0 |
| Complexity | 1140 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 19 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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