CHEBI:4647 - dipivefrin hydrochloride

ChEBI IDCHEBI:4647
ChEBI Namedipivefrin hydrochloride
Stars
DefinitionThe hydrochloride salt of dipivefrin. It is used topically as eye drops to reduce intra-ocular pressure in the treatment of open-angle glaucoma or ocular hypertension.
Last Modified20 May 2013
DownloadsMolfile
FormulaC19H29NO5.HCl
Net Charge0
Average Mass387.904
Monoisotopic Mass387.18125
SMILESCNCC(O)c1ccc(OC(=O)C(C)(C)C)c(OC(=O)C(C)(C)C)c1.Cl
InChIInChI=1S/C19H29NO5.ClH/c1-18(2,3)16(22)24-14-9-8-12(13(21)11-20-7)10-15(14)25-17(23)19(4,5)6;/h8-10,13,20-21H,11H2,1-7H3;1H
InChIKeyVKFAUCPBMAGVRG-UHFFFAOYSA-N
Roles Classification
Biological Roles:
sympathomimetic agent  A drug that mimics the effects of stimulating postganglionic adrenergic sympathetic nerves. Included in this class are drugs that directly stimulate adrenergic receptors and drugs that act indirectly by provoking the release of adrenergic transmitters.
adrenergic agonist  An agent that selectively binds to and activates adrenergic receptors.
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.
sympathomimetic agent  A drug that mimics the effects of stimulating postganglionic adrenergic sympathetic nerves. Included in this class are drugs that directly stimulate adrenergic receptors and drugs that act indirectly by provoking the release of adrenergic transmitters.
adrenergic agonist  An agent that selectively binds to and activates adrenergic receptors.
ChEBI Ontology
Outgoing Relation(s)
dipivefrin hydrochloride (CHEBI:4647) has part dipivefrin(1+) (CHEBI:73714)
dipivefrin hydrochloride (CHEBI:4647) has role adrenergic agonist (CHEBI:37886)
dipivefrin hydrochloride (CHEBI:4647) has role antiglaucoma drug (CHEBI:39456)
dipivefrin hydrochloride (CHEBI:4647) has role sympathomimetic agent (CHEBI:35524)
dipivefrin hydrochloride (CHEBI:4647) is a hydrochloride (CHEBI:36807)
IUPAC Name 
2-{3,4-bis[(2,2-dimethylpropanoyl)oxy]phenyl}-2-hydroxy-N-methylethanaminium chloride
Synonyms  Source
4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diyl bis(2,2-dimethylpropanoate) hydrochlorideIUPAC
dipivefrin HClChemIDplus
1-(3',4'-dipivaloyloxyphenyl)-2-methylamino-1-ethanol hydrochlorideChEBI
dipivefrine HClChEBI
dipivefrine hydrochlorideChemIDplus
Manual XrefsDatabases
D01017KEGG DRUG
DB00449DrugBank
Registry NumbersSources
Beilstein:6458483Beilstein
CAS:64019-93-8KEGG DRUG
CAS:64019-93-8ChemIDplus