
Toxicology
Found 13573 products of "Toxicology"
rac 8,14-Dihydroxy Efavirenz 14-O-β-D-Glucuronide 8-O-Sulfate
CAS:Controlled ProductFormula:C20H17ClF3NO13SColor and Shape:NeatMolecular weight:603.861D-Penicillamine N,S-Acetonide Acyl Lactoside Adduct
Controlled ProductFormula:C20H35NO12SColor and Shape:NeatMolecular weight:513.5562-(2-Fluorophenyl)thiopene
CAS:Controlled ProductFormula:C10H7FSColor and Shape:NeatMolecular weight:178.226(2R,3R)-2-(2-Fluoro-4-(4-methylenepiperidin-1-yl)phenyl)-3-(4-methylenepiperidin-1-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
CAS:Controlled ProductFormula:C24H32FN5OColor and Shape:NeatMolecular weight:425.542(3S,3aR,6aS)-Hexahydrofuro[2,3-b]furan-3-yl 4-Nitrophenyl Ester Carbonic Acid
CAS:Controlled ProductFormula:C13H13NO7Color and Shape:NeatMolecular weight:295.245(8’-E)-Daptomycin
Controlled ProductFormula:C72H99N17O26Color and Shape:NeatMolecular weight:1618.655N-Acetyl Darunavir
CAS:Controlled ProductFormula:C29H39N3O8SColor and Shape:NeatMolecular weight:589.7N-(4-Aminobenzenesulfonyl) Sulfamethoxazole N-Acetate
CAS:Controlled ProductFormula:C18H18N4O6S2Color and Shape:NeatMolecular weight:450.4892-[[(2,4-Difluorophenyl)methyl]amino]-2-oxo-acetic acid
CAS:Controlled ProductFormula:C9H7F2NO3Color and Shape:NeatMolecular weight:215.154Amoxicillin Open Ring Methyl Ester
CAS:Controlled ProductFormula:C17H23N3O6SColor and Shape:NeatMolecular weight:397.4461’-epi-Entecavir-di-o-benzyl Ether
CAS:Controlled ProductFormula:C26H27N5O3Color and Shape:NeatMolecular weight:457.524Posaconazole Acetate
CAS:Controlled ProductFormula:C39H44F2N8O5Color and Shape:NeatMolecular weight:742.814(2S,3S,5S)-2-(2,6-Dimethylphenoxyacetyl)amino-3-hydroxy-5-trifluromethylcarbonylamino-1,6-diphenylhexane
Controlled ProductFormula:C30H33F3N2O4Color and Shape:NeatMolecular weight:542.589Tenofovir N-Isopropyl Derivative
Controlled ProductFormula:C12H20N5O4PColor and Shape:NeatMolecular weight:329.292Cobicistat Open Morpholine
Controlled ProductFormula:C39H51N7O6S2Color and Shape:NeatMolecular weight:778.0N(hydrazido)-Des(N-(Methoxycarbonyl)-3-methyl-L-valinamido)-[(4S)-4-(1,1-Dimethylethyl)-2,5-dioxo-1-imidazolidinyl] Atazanavir
Controlled ProductFormula:C37H48N6O6Color and Shape:NeatMolecular weight:672.81cis-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolane-4-methanol Benzoate (Ester)
CAS:Controlled ProductApplications cis-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolane-4-methanol Benzoate (Ester) is an intermediate in the synthesis of trans-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolane-4-methanol (D431560). trans-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolane-4-methanol is an impurity of Ketoconazole (K186000).
References Ryu, J., et al. Bull. Korean Chem. Soc., 24, 460 (2003)Formula:C21H18Cl2N2O4Color and Shape:NeatMolecular weight:433.2852-[4-(Dimethylamino)phenyl]-1,2-benzothiazol-3-one
CAS:Controlled ProductFormula:C15H14N2OSColor and Shape:NeatMolecular weight:270.349Methoxy Cefadroxil
Controlled ProductApplications Methoxy Cefadroxil is an impurity of Cefadroxil (C235750), a semi-synthetic cephalosporin antibiotic. Antibacterial.
References Buck, R.E., et al.: Antimicrob. Agents Chemother., 11, 324 (1977);Formula:C17H19N3O6SColor and Shape:NeatMolecular weight:393.41424(28)-Dehydroergosterol
CAS:Controlled ProductFormula:C28H42OColor and Shape:NeatMolecular weight:394.632N-Desdecanoyl, N-(Undecanoyl) Daptomycin
CAS:Controlled ProductApplications N-Desdecanoyl, N-(Undecanoyl) Dapotmycin is an impurity of Daptomycin (D193350), cyclic lipopeptide antibiotic derived from a fermentation product of Streptomyces roseosporus; disrupts plasma membrane function in gram-positive bacteria. Antibacterial.
References Allen, N.E., et al.: Antimicrob. Agents Chemother., 31, 1093 (1987), Tully, F.P., et al.: Expert Opin. Invest. Drugs, 8, 1223 (1999),Formula:C73H103N17O26Color and Shape:NeatMolecular weight:1634.697Tenofovir Alafenamide Dimer
Controlled ProductFormula:C43H58N12O10P2Color and Shape:NeatMolecular weight:964.942Cloxacillin Sodium EP Impurity B
CAS:Controlled ProductFormula:C18H20ClN3O4SColor and Shape:NeatMolecular weight:409.887Benzylpenicillin Impurity 4
CAS:Controlled ProductFormula:C19H24N2O7SColor and Shape:NeatMolecular weight:424.468Gamithromycin 3'-N-Oxide
Controlled ProductFormula:C40H76N2O13Color and Shape:NeatMolecular weight:793.037N-Ethyl-N-(4-(chlorosulfonyl))sulfanilic Acid Sulfonyl Chloride
Controlled ProductFormula:C15H15Cl2NO4S2Color and Shape:NeatMolecular weight:408.326'-Sialyl-N-acetyllactosamine-β-ethylamine
CAS:Controlled ProductFormula:C27H47N3O19Color and Shape:NeatMolecular weight:717.6714-Amino-N-((2R,3S)-3-amino-2-(3-(3R,3aS,6aR)-hexahydro-furo[2,3-b]furanyl)oxycarbonyloxy-4-phenylbutyl)-N-(isobutyl)benzene Sulfonamide
Controlled ProductFormula:C27H37N3O7SColor and Shape:NeatMolecular weight:547.664(5R)-Flucloxacillin N4-Acetyl Penilloic Acid
Controlled ProductApplications (5R)-Flucloxacillin N4-Acetyl Penilloic Acid is an impurity of Flucloxacillin (F419200), a new semisynthetic penicillin.
References Markovich, M., et al.: Antibiot. Med. Biotekhnol., 31, 603 (1986); Rahman, M., et al.: Biochem. Pharmacol., 46, 1721 (1993); Silva, D., et al.: Med. Biol. Res., 37, 963 (2004);Formula:C21H21ClFN3O7SColor and Shape:NeatMolecular weight:513.92Amoxicillin (3-Ethoxy-1-methyl-3-oxo-1-propenyl)amino Diethylethanamine
CAS:Controlled ProductApplications Amoxicillin (3-Ethoxy-1-methyl-3-oxo-1-propenyl)amino Diethylethanamine is an intermediate in the synthesis of APA Amoxicillin Amide (A634270), which is a derivative of Amoxicillin (A634235), a semi-synthetic antibiotic related to penicillin. Antibacterial.
References Brogden, R.N., et al.: Drugs, 18, 169 (1979), Bird, A.E., et al.: Anal. Profiles Drug Subs. Excip., 23, 1 (1994),Formula:C22H27N3O7S•C6H15NColor and Shape:NeatMolecular weight:477.53 + 101.19O-Methyl 12-epi-Dolutegravir
CAS:Controlled ProductFormula:C21H21F2N3O5Color and Shape:NeatMolecular weight:433.40511-Oxo-fluticasone Furoate
CAS:Controlled ProductApplications 11-Oxo-fluticasone Furoate is an impurity of Fluticasone(F599500); an anti-inflammatory agent and a steroid.
References Meltzer, E. O., et al.: J. Allergy Clin. Immunol., 86, 221 (1990), Mitchison, H. C., et al.: Gut, 32, 260 (1991)Formula:C26H26F2O6SColor and Shape:NeatMolecular weight:504.5434-Desmethylene-4-hydroxymethyl-efinaconazole
Controlled ProductApplications 4-Desmethylene-4-hydroxymethyl-efinaconazole is a degradation product and potentially a metabolite of the antifungal drug Efinaconazole (E435070).
References Sugiura, K., et. al.: Antimicrob. Agents CH., 58, 3837 (2014);Formula:C18H24F2N4O2Color and Shape:NeatMolecular weight:366.406N-tert-Butyl Formyl Isavuconazonium Iodide Salt
CAS:Controlled ProductFormula:C40H43F2N8O7S•IColor and Shape:NeatMolecular weight:944.79ABT-639 Hydrochloride
CAS:Controlled ProductFormula:C20H20ClF2N3O3S·ClHColor and Shape:NeatMolecular weight:492.3671,3-Diphenylpyrimidine-2,4,6(1H,3H,5H)-trione
CAS:Controlled ProductFormula:C16H12N2O3Color and Shape:NeatMolecular weight:280.2787-Amino-5-oxide Cefaclor
CAS:Controlled ProductFormula:C7H7ClN2O4SColor and Shape:NeatMolecular weight:250.66Thio-hydroxy Fluticasone Furoate
CAS:Controlled ProductFormula:C26H28F2O7SColor and Shape:NeatMolecular weight:522.558Remdesivir Carboxylic Acid
CAS:Controlled ProductFormula:C21H23N6O8PColor and Shape:NeatMolecular weight:520.43Ritonavir Impurity Q
Controlled ProductFormula:C37H48N6O5S2Color and Shape:NeatMolecular weight:720.944Ketoconazole-N-methylformamide
CAS:Controlled ProductFormula:C26H30Cl2N4O6Color and Shape:NeatMolecular weight:565.4462-(1-Amino-1-methylethyl)-N-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide
CAS:Controlled ProductApplications An intermediate in the preparation of HIV-integrase inhibitors
References Summa, V., et al.: J. Med. Chem., 51, 5843 (2008),Formula:C16H19FN4O3Color and Shape:NeatMolecular weight:334.355-Chloro-4-(3-chloro-4-methylphenyl)-2-cyano-N,N-dimethyl-1H-imidazole-1-sulfonamide
Controlled ProductFormula:C13H12Cl2N4O2SColor and Shape:NeatMolecular weight:359.2314-Deschloro-4-hydroxy Clofazimine
CAS:Controlled ProductFormula:C27H23ClN4OColor and Shape:NeatMolecular weight:454.951Ethyl 7-Chloro-4-ethoxy-6-fluoro-3,4-dihydroquinoline-3-carboxylate
CAS:Controlled ProductApplications Ethyl 7-Chloro-4-ethoxy-6-fluoro-3,4-dihydroquinoline-3-carboxylate is an intermediate in the synthesis of Norfloxacin (N681000), which is a Pefloxacin derivative as antibacterial. Fluorinated quinolone antibacterial. This compound is a contaminant of emerging concern (CECs).
References Koga, H., et al.: J. Med. Chem., 23, 1358 (1980); Hirai, K., et al.: Antimicrob. Agents Chemother., 19, 188 (1981); Holmes, B., et al.: Drugs, 30, 482 (1985)Formula:C14H13ClFNO3Color and Shape:NeatMolecular weight:297.712-Fluorohexanoic Acid
CAS:Controlled ProductFormula:C6H11FO2Color and Shape:NeatMolecular weight:134.149tert-Butyl N-[rel-(3R,4R)-3-methyl-4-piperidyl]carbamate
CAS:Controlled ProductFormula:C11H22N2O2Color and Shape:NeatMolecular weight:214.3055-Chloro-1H-pyrazolo[3,4-b]pyridine
CAS:Controlled ProductFormula:C6H4ClN3Color and Shape:NeatMolecular weight:153.569Sodium Testosterone-16,16,17-d3 Sulfate
CAS:Controlled ProductFormula:C19D3H24O5S·NaColor and Shape:NeatMolecular weight:393.49Stavudine-α,α,α,6-d4
CAS:Controlled ProductApplications Stavudine-alpha,alpha,alpha,6-d4 (CAS# 1219803-67-4) is a useful isotopically labeled research compound.
Formula:C10H8D4N2O4Color and Shape:NeatMolecular weight:228.24(±)-Betaxolol-d7 HCl (iso-propyl-d7)
CAS:Controlled ProductApplications (±)-Betaxolol-d7 HCl (iso-propyl-d7) (CAS# 1219802-92-2) is a useful isotopically labeled research compound.
Formula:C18H23D7ClNO3Color and Shape:NeatMolecular weight:350.934-Pregnen-6α-methyl-17-ol-3,20-dione-2,2,4,6,21,21,21-d7
CAS:Controlled ProductFormula:C22D7H25O3Color and Shape:NeatMolecular weight:351.54rac-cis-N-Desmethyl Sertraline-d3 Hydrochloride
CAS:Controlled ProductApplications rac-cis-N-Desmethyl Sertraline-d3 hydrochloride is a labelled metabolite of rac-cis-N-Desmethyl sertraline hydrochloride (D292100). N-Desmethyl sertraline is significantly less active analogue as compared to the methylated compound, sertraline.
References Welch, W.M., et al.: J. Med. Chem. 27, 1508 (1984)Formula:C16H13D3Cl3NColor and Shape:NeatMolecular weight:331.68(±)-Zopiclone-d3 (N-methyl-d3)
CAS:Controlled ProductApplications (±)-Zopiclone-d3 (N-methyl-d3) (CAS# 1398066-10-8) is a useful isotopically labeled research compound.
Formula:C17H14D3ClN6O3Color and Shape:NeatMolecular weight:391.834-Pregnen-17α-ol-3,20-dione-2,2,4,6,6,21,21,21-d8 Hexanoate
CAS:Controlled ProductFormula:C27D8H32O4Color and Shape:NeatMolecular weight:436.66Diphenyl (Hydroxymethyl)phosphonate
CAS:Controlled ProductApplications Diphenyl (Hydroxymethyl)phosphonate is a reagent for the synthesis of amidate prodrugs of novel nucleoside phosphonate HIV reverse transcriptase (RT) inhibitor GS-9148.
References Mackman, R. L., et al.: Bioorg. Med. Chem., 18, 3606 (2010)Formula:C13H13O4PColor and Shape:NeatMolecular weight:264.214(R)-N-Aminodimethylbutyl-3-deshydroxy-3-chloro Valganciclovir
Controlled ProductFormula:C19H30ClN7O5Color and Shape:NeatMolecular weight:471.938N-[1-(4-Ethylphenyl)ethylidene]-4-methylbenzenesulfonamide
CAS:Controlled ProductFormula:C17H19NO2SColor and Shape:NeatMolecular weight:301.403N(amino),O(oxime)-di-tert-butoxycarbonyl-7-[[(2Z)-2-(2-Amino-4-thiazolyl)-2-[(carboxymethoxy)imino]acetyl]amino]-cefixime Dibenzhydryl Ester
Controlled ProductFormula:C58H56N8O13S3Color and Shape:NeatMolecular weight:1169.3063'-Hydroxy-5,7,4'-trimethoxy-4-phenylcoumarin
CAS:Controlled ProductFormula:C18H16O6Color and Shape:NeatMolecular weight:328.316N-Boc-6-hydroxymethyl-1,2,3,4-tetrahydroisoquinoline
CAS:Controlled ProductFormula:C15H21NO3Color and Shape:NeatMolecular weight:263.343-Methoxy-4-methyl-2-nitropyridine
CAS:Controlled ProductFormula:C7H8N2O3Color and Shape:NeatMolecular weight:168.15Clindamycin Palmitate Hydrochloride
CAS:Controlled ProductApplications Clindamycin Palmitate is a semi-synthetic antibiotic with high bioavailability. Clindamycin Palmitate is an antibacterial.
References Platzer, D., et al.: J. Pharm. Biomed. Anal., 41, 84 (2006),Formula:C34H63ClN2O6S·ClHColor and Shape:NeatMolecular weight:699.852-Propen-1-yl Ester Amphoteronolide B
CAS:Controlled ProductFormula:C44H66O14Color and Shape:NeatMolecular weight:818.986Benzyl ((2R,3S)-3-Hydroxy-1,4-bis(phenylthio)butan-2-yl)carbamate
Controlled ProductFormula:C24H25NO3S2Color and Shape:NeatMolecular weight:439.594-Chloro-5-(3-chloro-4-methylphenyl)-2-cyano-N,N-dimethyl-1H-imidazole-1-sulfonamide
CAS:Controlled ProductFormula:C13H12Cl2N4O2SColor and Shape:NeatMolecular weight:359.231Desmethyl Nafcillin Sodium Salt
CAS:Controlled ProductApplications Desmethyl Nafcillin Sodium Salt is derived from (+)-6-Aminopenicillanic Acid (A618895), which is the core structure in penicillins, obtained from the fermentation brew of the Penicillium mold. (+)-6-Aminopenicillanic Acid is used as the main starting block for the preparation of numerous semisynthetic penicillins.
References Zel'tser, I.Z. et al.: Gig. Truda Prof. Zabol., 5, 59 (1983); Hamilton-Miller, J.M.T.: Int. J. Antimicrob. Agents, 31, 189 (2008); Novikova, N.D. et al.: Mikol. Fitopatol., 7, 101 (1973)Formula:C20H20N2O5S·NaColor and Shape:NeatMolecular weight:423.438Sericic Acid
CAS:Controlled ProductApplications Sericic acid is an antioxidant, PDE4A inhibitor, antiinflammatory, antifungal, and antibacterial.
Formula:C30H48O6Color and Shape:NeatMolecular weight:504.76-Defluoro-piperazinyl 7-Depiperazinyl-chloro Norfloxacin
CAS:Controlled ProductFormula:C16H18ClN3O3Color and Shape:NeatMolecular weight:335.79(1S,3S,4R)-3-(6-Bromo-1H-benzimidazol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylic Acid 1,1-Dimethylethyl Ester
Controlled ProductFormula:C18H22BrN3O2Color and Shape:NeatMolecular weight:392.292-(Pyrimidin-4-yl)acetic Acid
CAS:Controlled ProductFormula:C6H6N2O2Color and Shape:NeatMolecular weight:138.124Ophenyl-[4”-(Pentyloxy)[1,1’:4’,1”-terphenyl]-4-yl]carbonyl] Anidulafungin
Controlled ProductApplications Ophenyl-[4”-(Pentyloxy)[1,1’:4’,1”-terphenyl]-4-yl]carbonyl] Anidulafungin is an impurity of Anidulafungin (A673000) which is used as an antifungal drug.
References Denning, D. W., et al.: J. Antimicrob. Chemother, 40, 611 (1997); Vazquez, J. A., et al.: Clin. Ther., 27(6), 657 (2005);Formula:C82H95N7O19Color and Shape:NeatMolecular weight:1482.667H-Lys(Tos)-Oh Hydrochloride
CAS:Controlled ProductFormula:C13H20N2O4S·HClColor and Shape:NeatMolecular weight:336.83O-Tri-t-Butyldimethylsilyl Tylosin Acetate
Controlled ProductFormula:C65H119NO18Si3Color and Shape:NeatMolecular weight:1286.8931,9-Dihydro-9-[[2-hydroxy-1-[[(4-methoxyphenyl)diphenylmethoxy]methyl]ethoxy]methyl]-2-[[(4-methoxyphenyl)diphenylmethyl]amino]-6H-purin-6-one
CAS:Controlled ProductApplications 1,9-Dihydro-9-[[2-hydroxy-1-[[(4-methoxyphenyl)diphenylmethoxy]methyl]ethoxy]methyl]-2-[[(4-methoxyphenyl)diphenylmethyl]amino]-6H-purin-6-one is an intermediate used in the synthesis of Ganciclovir Triphosphate Triethylamine Salt (G235030), which is an inhibitor of hepatitis B virus DNA polymerase and has shown potent antiviral activity against herpes viruses and hepadnaviruses.
References Rubsam, L.Z., et al.: Cancer. Res., 59, 669 (1999); Shaw, T., et al.: Hepatol., 24, 996 (1996);Formula:C49H45N5O6Color and Shape:NeatMolecular weight:799.912Benzhydryl 7-Amino-7-methoxycephalosporanate
CAS:Controlled ProductFormula:C24H24N2O6SColor and Shape:NeatMolecular weight:468.522(-)-Deoxyhalofebrifugine Dihydrobromide
CAS:Controlled ProductFormula:C16H17BrClN3O2·2HBrColor and Shape:NeatMolecular weight:560.5113-O-Methyl-amphoteronolide B 2-Propen-1-yl Ester
CAS:Controlled ProductFormula:C45H68O14Color and Shape:NeatMolecular weight:833.0134-Chloro-3-fluorobenzoic Acid
CAS:Controlled ProductApplications 4-Chloro-3-fluorobenzoic Acid is a very useful precursor. It is a reagent used to synthesize 6-Hydroxy Albaconazole (H761395) which is a metabolite of Albaconazole (A511450), an antifungal agent as neuroprotectant.
References Pujol, I., et al.: J. Antimicrob. Chemother., 39, 163 (1997), Gilgado, F., et al.: J. Clin. Microbiol., 43, 4930 (2005), Raad, I., et al.: Clin. Infect. Dis., 42, 1398 (2006), Nucci, M., et al.: Clin. Microbiol. Rev., 20, 695 (2007),Formula:C7H4ClFO2Color and Shape:NeatMolecular weight:174.562-Amino-9-((1S,3S,4S)-4-(benzyloxy)-3-((benzyloxy)methyl)-2-methylenecyclopentyl)-1H-purin-6(9H)-one
Controlled ProductFormula:C26H27N5O3Color and Shape:NeatMolecular weight:457.524cis-3-Hexenyl Salicylate
CAS:Controlled ProductFormula:C13H16O3Color and Shape:NeatMolecular weight:220.26Diacetyl (6,7-Dichloro-1-ethyl-1,4-dihydro-4-oxo-3-quinolinecarboxy Borate)
Controlled ProductFormula:C16H14BCl2NO7Color and Shape:NeatMolecular weight:414.002(R)-7,8-Dihydroxy Efavirenz
CAS:Controlled ProductFormula:C14H9ClF3NO4Color and Shape:NeatMolecular weight:347.6741,2-Dihydro-6-methyl-4-(1-methylethyl)naphthalene
CAS:Controlled ProductFormula:C14H18Color and Shape:NeatMolecular weight:186.293But-2-ene-2-Desfluorophenyl Efinaconazole
Controlled ProductFormula:C18H21FN4OColor and Shape:NeatMolecular weight:328.384Des-(6-Flouro) 6-Methyl Favipiravir
CAS:Controlled ProductFormula:C6H7N3O2Color and Shape:NeatMolecular weight:153.13923-O-Desmycinosyl-tylosin
CAS:Controlled ProductFormula:C38H63NO13Color and Shape:NeatMolecular weight:741.9062-Methyl-5-thiazolyl-boronic Acid
CAS:Controlled ProductFormula:C4H6BNO2SColor and Shape:NeatMolecular weight:142.972(3-[(7-Chloro-1-benzothien-3-yl)methyl]-1-[2-[(7-chloro-1-benzothien-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]-1H-imidazol-3-ium Bromide
Controlled ProductFormula:C29H21BrCl4N2OS2·BrColor and Shape:NeatMolecular weight:699.32Ethanol Ring-opened Aztreonam
Controlled ProductImpurity Aztreonam
Applications Ethanol Ring-opened Aztreonam is an Aztreonam (A965200) in-house impurity 1. Aztreonam is the first totally synthetic monocyclic β-lactam antibiotic.
References Sykes, R.B., et al.: Antimicrob. Agents Chemother., 21, 85 (1982), Florey, K., et al.: Anal. Profiles Drug Subs., 17, 1 (1988),Formula:C15H23N5O8S2Color and Shape:NeatMolecular weight:465.502
