Amphotericin b methyl ester hydrochloride
methyl (1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,33R,35S,36R,37S)-33-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylate;hydrochloride
Also Known As: amphotericin b methyl ester hydrochloride
| Molecular Formula | C48H76ClNO17 |
|---|---|
| Molecular Weight | 973.48016 g/mol |
| LogP | 1.2219 |
| Topological Polar Surface Area | 309.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 4 |
| Exact Mass | 973.48016 |
| Monoisotopic Mass | 973.48016 |
| Heavy Atoms | 67 |
| Complexity | 1680.0 |
Chemical Identifiers
| CAS Number | 35375-29-2 |
|---|---|
| SMILES | C[C@H]1C=CC=CC=CC=CC=CC=CC=C[C@@H](C[C@H]2[C@@H]([C@H](C[C@](O2)(C[C@H](C[C@H]([C@@H](CC[C@H](C[C@H](CC(=O)O[C@H]([C@@H]([C@@H]1O)C)C)O)O)O)O)O)O)O)C(=O)OC)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)O)N)O.Cl |
| InChIKey | FCUABMXRRQIKMV-ZZAPUJMKSA-N |
Product Overview
Amphotericin b methyl ester hydrochloride (CAS 35375-29-2), with molecular formula C48H76ClNO17 and molecular weight 973.48016 g/mol. IUPAC: methyl (1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,33R,35S,36R,37S)-33-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylate;hydrochloride.