BioModels Ontology

Last uploaded: April 3, 2012
Preferred Name

diltiazem

Synonyms
Definitions

The (S,S)-diastereoisomer of 2,3-dihydro-1,5-benzothiazepin-4(5H)-one in which positions 2 and 3 are substituted by 4-methoxyphenyl and acetoxy, respectively, while the hydrogen attached to the nitrogen is substituted by a 2-(dimethylamino)ethyl group. A calcium-channel blocker and vasodilator, it is used as the hydrochloride in the management of angina pectoris and hypertension.

ID

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

alternative term

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

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

diltiazemum

DILTIAZEM

InChI=1S/C22H26N2O4S/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/t20-,21+/m1/s1

C22H26N2O4S

(2S,3S)-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate

(2S-cis)-3-(acetyloxy)-5-[2-(dimethylamino)ethyl]-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one

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

COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O

InChIKey=HSUGRBWQSSZJOP-RTWAWAEBSA-N

diltiazem

Diltiazem

definition

The (S,S)-diastereoisomer of 2,3-dihydro-1,5-benzothiazepin-4(5H)-one in which positions 2 and 3 are substituted by 4-methoxyphenyl and acetoxy, respectively, while the hydrogen attached to the nitrogen is substituted by a 2-(dimethylamino)ethyl group. A calcium-channel blocker and vasodilator, it is used as the hydrochloride in the management of angina pectoris and hypertension.

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

prefixIRI

CHEBI:101278

prefLabel

diltiazem

subClassOf

http://purl.obolibrary.org/obo/CHEBI_48684

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http://purl.obolibrary.org/obo/CHEBI_101278 EFO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 FIDEO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 DINTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 HOIP SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 TXPO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 DIDEO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_101278 ODNAE SAME_URI
http://purl.obolibrary.org/obo/XCO_0001152 XCO LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#3959 OCHV LOOM
http://purl.bioontology.org/ontology/ATC/C05AE03 ATC LOOM
http://purl.bioontology.org/ontology/LNC/MTHU060482 LOINC LOOM
http://purl.bioontology.org/ontology/VANDF/4019722 VANDF LOOM
http://bmi.utah.edu/ontologies/hfontology/C0012373 HFO LOOM
http://purl.bioontology.org/ontology/MESH/D004110 MESH LOOM
https://go.drugbank.com/drugs/DB00343 MDM LOOM
http://purl.jp/bio/4/id/200906048708111286 IOBC LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C61725 NCIT LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147814 NDFRT LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 EFO LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 FIDEO LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 DINTO LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 HOIP LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 TXPO LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 DIDEO LOOM
http://purl.obolibrary.org/obo/CHEBI_101278 ODNAE LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000147814 ODAE LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000147814 OCVDAE LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.438.079.150 RH-MESH LOOM
http://purl.bioontology.org/ontology/CSP/0314-7897 CRISP LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0012373 OCHV LOOM
http://stirdf.jst.go.jp/id/200907033930021577 IOBC LOOM
http://www.phoc.org.cn/pmo/class/PMO_00017595 PMAPP-PMO LOOM
http://purl.obolibrary.org/obo/NCIT_C61725 BERO LOOM
http://purl.bioontology.org/ontology/RXNORM/3443 RXNORM LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/372793000 SNOMEDCT LOOM
http://purl.obolibrary.org/obo/MESH_D004110 BERO LOOM
http://www.semanticweb.org/administrator/ontologies/2022/0/untitled-ontology-34#OWLClassbae370ac_6599_4153_844f_985afb86dce0 WWECA LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D004110 RH-MESH LOOM
http://purl.bioontology.org/ontology/RCD/x01CU RCD LOOM
http://purl.bioontology.org/ontology/SNMI/C-803A0 SNMI LOOM
http://purl.bioontology.org/ontology/ATC/C08DB01 ATC LOOM
http://purl.obolibrary.org/obo/OMIT_0005375 OMIT LOOM
http://mimi.case.edu/ontologies/2009/9/DrugOntology#diltiazem SDO LOOM
http://www.co-ode.org/ontologies/galen#Diltiazem GALEN LOOM
http://www.drugbank.ca/drugs/DB00343 FTC LOOM
http://purl.bioontology.org/ontology/LNC/LP17238-4 LOINC LOOM