loading...| Preferred Name |
diltiazem hydrochloride |
|
| Synonyms |
(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate hydrochloride Diltiazem hydrochloride diltiazem HCl (+)-5-(2-(dimethylamino)ethyl)-cis-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate ester monohydrochloride 2-[(2S,3S)-3-(acetyloxy)-2-(4-methoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N,N-dimethylethanaminium chloride (2S-cis)-3-acetoxy-5-(2-(dimethylamino)ethyl)-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one monohydrochloride 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 |
|
| Definitions |
A hydrochloride salt resulting from the reaction of equimolar amounts of diltiazem and hydrogen chloride. 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 |
|
| charge |
0 |
|
| database_cross_reference |
KEGG:D00616 Beilstein:4228706 CAS:33286-22-5 DrugBank:DB00343 |
|
| definition |
A hydrochloride salt resulting from the reaction of equimolar amounts of diltiazem and hydrogen chloride. A calcium-channel blocker and vasodilator, it is used in the management of angina pectoris and hypertension. |
|
| formula |
C22H27ClN2O4S |
|
| has part | ||
| has_alternative_id |
CHEBI:210872 CHEBI:4603 |
|
| has_exact_synonym |
(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate hydrochloride Diltiazem hydrochloride |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
diltiazem HCl (+)-5-(2-(dimethylamino)ethyl)-cis-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate ester monohydrochloride 2-[(2S,3S)-3-(acetyloxy)-2-(4-methoxyphenyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N,N-dimethylethanaminium chloride (2S-cis)-3-acetoxy-5-(2-(dimethylamino)ethyl)-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one monohydrochloride 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 |
|
| id |
CHEBI:645509 |
|
| in_subset | ||
| inchi |
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 |
|
| inchikey |
HDRXZJPWHTXQRI-BHDTVMLSSA-N |
|
| is_enantiomer_of | ||
| label |
diltiazem hydrochloride |
|
| mass |
450.97900 |
|
| monoisotopicmass |
450.13801 |
|
| notation |
CHEBI:645509 |
|
| prefLabel |
diltiazem hydrochloride |
|
| RO_0000087 |
http://purl.obolibrary.org/obo/CHEBI_35620 |
|
| smiles |
Cl.COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O |
|
| subClassOf |