Roxithromycin EP Impurity E

cas: 1460313-66-9 — see every product listed under this CAS number, including other names

Roxithromycin EP Impurity E (CAS 1460313-66-9) is a chemical reagent available from Chemat. Available pack sizes: on request, Get quote. Offered by: Chemat Brand, MedChemExpress.

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catalog numberRM-R242005
cas1460313-66-9
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Structural formula: {0} (CAS {1})

(3R,4S,5S,6R,7R,9R,10E,11S,12R,13S,14R)-4-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-10-(2-methoxyethoxymethoxyimino)-3,5,7,9,11,13-hexamethyl-oxacyclotetradecan-2-one (CAS 1460313-66-9) is a chemical compound with the molecular formula C40H74N2O15 and a molecular weight of 823.0 g/mol. IUPAC name: (3R,4S,5S,6R,7R,9R,10E,11S,12R,13S,14R)-4-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-10-(2-methoxyethoxymethoxyimino)-3,5,7,9,11,13-hexamethyl-oxacyclotetradecan-2-one. InChIKey: HDTGNWORNXOTCR-IFQATVCDSA-N.

Identity
Molecular formulaC40H74N2O15
Molecular weight823.0 g/mol
IUPAC name(3R,4S,5S,6R,7R,9R,10E,11S,12R,13S,14R)-4-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-10-(2-methoxyethoxymethoxyimino)-3,5,7,9,11,13-hexamethyl-oxacyclotetradecan-2-one
InChIKeyHDTGNWORNXOTCR-IFQATVCDSA-N
SMILESCC[C@@H]1[C@@]([C@@H]([C@H](/C(=N/OCOCCOC)/[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)O)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O

Computed by PubChem (NCBI)

Synonyms: Roxithromycin EP Impurity E
Isomers (same molecular formula)
(3R,4S,5S,6R,7R,9R,10E,11S,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-6-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy-10-(2-methoxyethoxymethoxyimino)-3,5,7,9,11,13-hexamethyl-oxacyclotetradecan-2-one C40H74N2O15
(3R,4S,5S,6R,7R,9R,10E,11S,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-10-(2-hydroxyethoxymethoxyimino)-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 C40H74N2O15