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CHEBI:2669 - amlodipine benzenesulfonate

ChEBI IDCHEBI:2669
ChEBI Nameamlodipine benzenesulfonate
Stars
DefinitionThe benzenesulfonate salt of amlodipine.
Last Modified11 June 2015
DownloadsMolfile
FormulaC20H25ClN2O5.C6H6O3S
Net Charge0
Average Mass567.060
Monoisotopic Mass566.14896
SMILESCCOC(=O)C1=C(COCCN)NC(C)=C(C(=O)OC)C1c1ccccc1Cl.O=S(=O)(O)c1ccccc1
InChIInChI=1S/C20H25ClN2O5.C6H6O3S/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21;7-10(8,9)6-4-2-1-3-5-6/h5-8,17,23H,4,9-11,22H2,1-3H3;1-5H,(H,7,8,9)
InChIKeyZPBWCRDSRKPIDG-UHFFFAOYSA-N
Roles Classification
Biological Role:
calcium channel blocker  One of a class of drugs that acts by selective inhibition of calcium influx through cell membranes or on the release and binding of calcium in intracellular pools.
Applications:
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
vasodilator agent  A drug used to cause dilation of the blood vessels.
ChEBI Ontology
Outgoing Relation(s)
amlodipine benzenesulfonate (CHEBI:2669) has part amlodipine (CHEBI:2668)
amlodipine benzenesulfonate (CHEBI:2669) has role antihypertensive agent (CHEBI:35674)
amlodipine benzenesulfonate (CHEBI:2669) has role calcium channel blocker (CHEBI:38215)
amlodipine benzenesulfonate (CHEBI:2669) has role vasodilator agent (CHEBI:35620)
amlodipine benzenesulfonate (CHEBI:2669) is a organosulfonate salt (CHEBI:64382)
Incoming Relation(s)
Prestalia (CHEBI:85999) has part amlodipine benzenesulfonate (CHEBI:2669)
IUPAC Name 
3-ethyl 5-methyl 2-[(2-aminoethoxy)methyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate benzenesulfonate
INNs  Source
amlodipinoDrugBank
amlodipinumDrugBank
amlodipineChEBI
Synonyms  Source
Amlodipine besilateKEGG DRUG
Amlodipine besylateKEGG DRUG
Manual XrefsDatabases
D00615KEGG DRUG
DB00381DrugBank
Registry NumbersSources
Beilstein:8378713Beilstein
CAS:111470-99-6KEGG DRUG
CAS:111470-99-6ChemIDplus