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CHEBI:4703 - dorzolamide hydrochloride

Default Structure
ChEBI IDCHEBI:4703
ChEBI Namedorzolamide hydrochloride
Stars
DefinitionThe hydrochloride salt of dorzolamide. It is used in ophthalmic solutions to lower increased intraocular pressure in the treatment of open-angle glaucoma and ocular hypertension.
Last Modified21 July 2010
DownloadsMolfile
FormulaC10H17N2O4S3.Cl
Net Charge0
Average Mass360.910
Monoisotopic Mass360.00390
SMILESCC[NH2+][C@H]1C[C@H](C)S(=O)(=O)c2sc(S(N)(=O)=O)cc21.[Cl-]
InChIInChI=1S/C10H16N2O4S3.ClH/c1-3-12-8-4-6(2)18(13,14)10-7(8)5-9(17-10)19(11,15)16;/h5-6,8,12H,3-4H2,1-2H3,(H2,11,15,16);1H/t6-,8-;/m0./s1
InChIKeyOSRUSFPMRGDLAG-QMGYSKNISA-N
Roles Classification
Biological Role:
EC 4.2.1.1 (carbonic anhydrase) inhibitor  An EC 4.2.1.* (hydro-lyases) inhibitor that interferes with the action of carbonic anhydrase (EC 4.2.1.1). Such compounds reduce the secretion of H+ ions by the proximal kidney tubule.
Applications:
antiglaucoma drug  Any drug which can be used to prevent or alleviate glaucoma, a disease in which the optic nerve is damaged, resulting in progressive, irreversible loss of vision. It is often, though not always, associated with increased pressure of the fluid in the eye.
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
ChEBI Ontology
Outgoing Relation(s)
dorzolamide hydrochloride (CHEBI:4703) has part dorzolamide (CHEBI:4702)
dorzolamide hydrochloride (CHEBI:4703) has role antiglaucoma drug (CHEBI:39456)
dorzolamide hydrochloride (CHEBI:4703) has role antihypertensive agent (CHEBI:35674)
dorzolamide hydrochloride (CHEBI:4703) has role EC 4.2.1.1 (carbonic anhydrase) inhibitor (CHEBI:23018)
dorzolamide hydrochloride (CHEBI:4703) is a hydrochloride (CHEBI:36807)
dorzolamide hydrochloride (CHEBI:4703) is a organoammonium salt (CHEBI:46850)
IUPAC Name 
(SS,6S)-N-ethyl-6-methyl-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-aminium 7,7-dioxide chloride
Synonyms  Source
(4S,6S)-4-(ethylamino)-5,6-dihydro-6-methyl-4HH-thieno(2,3-b)thiopyran-2-sulfonamide 7,7-dioxide monohydrochlorideChemIDplus
(4S,6S)-4-(ethylamino)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide 7,7-dioxide hydrochlorideIUPAC
(4S,trans)-4-(ethylamino)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide 7,7-dioxide hydrochlorideChEBI
dorzolamide HClChemIDplus
Manual XrefsDatabases
D00653KEGG DRUG
DB00869DrugBank
Registry NumbersSources
Beilstein:5896026Beilstein
CAS:130693-82-2KEGG DRUG
CAS:130693-82-2ChemIDplus