BioModels Ontology

Last uploaded: April 3, 2012
Preferred Name

diltiazem hydrochloride

Synonyms
Definitions

The hydrochloride salt of diltiazem. A calcium-channel blocker and vasodilator, it is used in the management of angina pectoris and hypertension.

ID

http://purl.obolibrary.org/obo/CHEBI_645509

alternative term

C22H27ClN2O4S

Diltiazem hydrochloride

(+)-5-(2-(dimethylamino)ethyl)-cis-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate ester monohydrochloride

InChI=1S/C22H26N2O4S.ClH/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3;/h5-12,20-21H,13-14H2,1-4H3;1H/t20-,21+;/m1./s1

Acetic acid (2S,3S)-5-(2-dimethylamino-ethyl)-2-(4-methoxy-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-yl ester; hydrochloride

[Cl-].COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CC[NH+](C)C)C(=O)[C@@H]1OC(C)=O

(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate hydrochloride

diltiazem HCl

(2S-cis)-3-acetoxy-5-(2-(dimethylamino)ethyl)-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one monohydrochloride

InChIKey=HDRXZJPWHTXQRI-BHDTVMLSSA-N

2-[(2S,3S)-3-(acetyloxy)-2-(4-methoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N,N-dimethylethanaminium chloride

definition

The hydrochloride salt of diltiazem. A calcium-channel blocker and vasodilator, it is used in the management of angina pectoris and hypertension.

has part

http://purl.obolibrary.org/obo/CHEBI_101278

has role

http://purl.obolibrary.org/obo/CHEBI_35620

http://purl.obolibrary.org/obo/CHEBI_38215

http://purl.obolibrary.org/obo/CHEBI_35674

label

diltiazem hydrochloride

prefixIRI

CHEBI:645509

prefLabel

diltiazem hydrochloride

subClassOf

http://purl.obolibrary.org/obo/CHEBI_36807

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