1.0 2016-05-22 04:30:34 UTC 2026-08-22 14:17:47 UTC Roxithromycin SmallMolecule Roxithromycin belongs to the carbohydrates and carbohydrate conjugates, a subclass of organooxygen compounds within the organic compounds. With an average molecular weight of 837.05 g/mol, Roxithromycin is a heavy molecule. Its chemical formula is C41H76N2O15. The compound is identified as an antibiotic and is recorded as being found in or released from 20 different sources. These sources include healthcare, pharmaceuticals, and veterinary products. In the food, food processing, and cookware sector, it is associated with the processing of fish and the preparation of vinegar. It is also found in drinking water and water supply. Within household cleaning and consumer products, it is linked to tobacco pipes and pipe accessories. In building and construction, it is recorded in relation to tents or canopies, roofs, and sunshades awnings or outside screens. Additionally, it is found in electrical and electronic equipment, including amplifiers, antennas, auxiliary devices, electric hearing aids, and colour television systems, among six other sources. Exposure to Roxithromycin occurs through oral and inhalation routes. At the molecular level, the compound interacts with two recorded protein targets. It acts as an inhibitor of the large ribosomal subunit protein uL10 (rplJ) and interacts with the ATP-dependent translocase ABCB1. (3R,4S,5S,6R,7R,9R,11S,12R,13S,14R)-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-10-(2,4,7-trioxa-1-azaoctan-1-yl C41H76N2O15 837.0465 836.524569772 (3R,4S,5S,6R,7R,9R,11S,12R,13S,14R)-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-10-(2,4,7-trioxa-1-azaoctan-1-ylidene)-1-oxacyclotetradecan-2-one roxiβ 80214-83-1 CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)C(=NOCOCCOC)[C@H](C)[C@@H](O)[C@]1(C)O InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,30+,32-,33+,34-,35+,36-,38+,39-,40-,41-/m1/s1 RXZBMPWDPOLZGW-HITVVWEBSA-N Organic compounds Benzenoids Benzene and substituted derivatives Benzene and substituted derivatives Alkylhydrazines Hydrocarbon derivatives Organopnictogen compounds Alkylhydrazine Aromatic homomonocyclic compound Hydrazine derivative Hydrocarbon derivative Monocyclic benzene moiety Organic nitrogen compound Organonitrogen compound Organopnictogen compound Aromatic homomonocyclic compounds a small molecule primary amine Detected and Not Quantified Roxithromycin Action Pathway SMP0000251 Roxithromycin Anti=Bacterial Action Pathway SMP0123260 Roxithromycin Drug Metabolism Action Pathway SMP0143219 logp 3 logp 2.90 ALOGPS logs -3.65 ALOGPS solubility 1.87e-01 g/l ALOGPS logp 3 ChemAxon pka_strongest_acidic 12.45 ChemAxon pka_strongest_basic 9.08 ChemAxon iupac (3R,4S,5S,6R,7R,9R,11S,12R,13S,14R)-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-10-(2,4,7-trioxa-1-azaoctan-1-ylidene)-1-oxacyclotetradecan-2-one ChemAxon average_mass 837.0465 ChemAxon mono_mass 836.524569772 ChemAxon smiles CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)C(=NOCOCCOC)[C@H](C)[C@@H](O)[C@]1(C)O ChemAxon formula C41H76N2O15 ChemAxon inchi InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,30+,32-,33+,34-,35+,36-,38+,39-,40-,41-/m1/s1 ChemAxon inchikey RXZBMPWDPOLZGW-HITVVWEBSA-N ChemAxon polar_surface_area 216.89 ChemAxon refractivity 211.24 ChemAxon polarizability 91.84 ChemAxon rotatable_bond_count 13 ChemAxon acceptor_count 16 ChemAxon donor_count 5 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f721f0f2308> DB00778 6915744 5291557 BE0000743 BE0001032