The Drug Ontology

Last uploaded: March 3, 2024
Preferred Name

Pentamidine

Synonyms

4,4'-[pentane-1,5-diylbis(oxy)]dibenzenecarboximidamide

Pentamidine

1,5-bis(4-amidinophenoxy)pentane

4,4'-(pentamethylenedioxy)dibenzamidine

p,p'-(pentamethylenedioxy)dibenzamidine

4,4'-(1,5-pentanediylbis(oxy))bis-benzenecarboximidamide

pentamidine

4,4'-Diamidinodiphenoxypentane

pentamidin

Definitions

A diether consisting of pentane-1,5-diol in which both hydroxyl hydrogens have been replaced by 4-amidinophenyl groups. A trypanocidal drug that is used for treatment of cutaneous leishmaniasis and Chagas disease.

ID

http://purl.obolibrary.org/obo/CHEBI_45081

charge

0

database_cross_reference

Patent:US2008167296

PMID:26734860

KEGG:D08333

PMID:22200378

PMID:28074607

PMID:26295040

PMID:28263303

Patent:US2394003

Patent:GB507565

PMID:7690919

PMID:26052915

PMID:20599360

KEGG:C07420

PMID:11438428

PDBeChem:PNT

PMID:18346045

PMID:27011917

PMID:27600039

PMID:27353022

PMID:26418240

PMID:27729250

PMID:7542607

PMID:27164533

PMID:26431253

PMID:27297108

PMID:26938448

PMID:19966562

PMID:10415905

PMID:26606757

PMID:26344166

PMID:22046004

PMID:8841838

Wikipedia:Pentamidine

PMID:18971316

PMID:28167598

LINCS:LSM-4540

Drug_Central:2090

PMID:27214074

Patent:US7115665

HMDB:HMDB0014876

PMID:27135970

PMID:15711592

Patent:EP975608

PMID:26117647

Beilstein:3159790

DrugBank:DB00738

PMID:26648589

PMID:11584934

PMID:26882015

PMID:22327112

CAS:100-33-4

PMID:20144237

PMID:22093811

PMID:14603035

PMID:27357655

PMID:26903605

PMID:26515653

Reaxys:3159790

PMID:26824946

Patent:US2006235001

PMID:26828608

PMID:10917591

Patent:US2008214569

definition

A diether consisting of pentane-1,5-diol in which both hydroxyl hydrogens have been replaced by 4-amidinophenyl groups. A trypanocidal drug that is used for treatment of cutaneous leishmaniasis and Chagas disease.

formula

C19H24N4O2

has role

http://purl.obolibrary.org/obo/CHEBI_35703

http://purl.obolibrary.org/obo/CHEBI_130181

http://purl.obolibrary.org/obo/CHEBI_63673

http://purl.obolibrary.org/obo/CHEBI_136651

http://purl.obolibrary.org/obo/CHEBI_36335

http://purl.obolibrary.org/obo/CHEBI_67079

http://purl.obolibrary.org/obo/CHEBI_35718

http://purl.obolibrary.org/obo/CHEBI_76395

http://purl.obolibrary.org/obo/CHEBI_60643

has_alternative_id

CHEBI:45077

CHEBI:7976

has_exact_synonym

4,4'-[pentane-1,5-diylbis(oxy)]dibenzenecarboximidamide

Pentamidine

has_obo_namespace

chebi_ontology

has_related_synonym

1,5-bis(4-amidinophenoxy)pentane

4,4'-(pentamethylenedioxy)dibenzamidine

p,p'-(pentamethylenedioxy)dibenzamidine

4,4'-(1,5-pentanediylbis(oxy))bis-benzenecarboximidamide

pentamidine

4,4'-Diamidinodiphenoxypentane

pentamidin

has_RxCUI

7994

id

CHEBI:45081

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C19H24N4O2/c20-18(21)14-4-8-16(9-5-14)24-12-2-1-3-13-25-17-10-6-15(7-11-17)19(22)23/h4-11H,1-3,12-13H2,(H3,20,21)(H3,22,23)

inchikey

XDRYMKDFEDOLFX-UHFFFAOYSA-N

is conjugate base of

http://purl.obolibrary.org/obo/CHEBI_64383

label

Pentamidine

pentamidine

mass

340.420

monoisotopicmass

340.18993

notation

CHEBI:45081

prefLabel

Pentamidine

smiles

C(CCCOC1=CC=C(C=C1)C(N)=N)COC2=CC=C(C=C2)C(N)=N

subClassOf

http://purl.obolibrary.org/obo/CHEBI_35618

http://purl.obolibrary.org/obo/CHEBI_46786

http://purl.obolibrary.org/obo/CHEBI_35359

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Delete Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_45081 EFO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45081 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45081 DINTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45081 COVID-19 SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45081 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45081 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45081 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45081 NIFSTD SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45081 PHIPO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_45081 ODNAE SAME_URI
http://purl.bioontology.org/ontology/SNMI/C-52050 SNMI LOOM
http://purl.obolibrary.org/obo/OMIT_0011413 OMIT LOOM
http://purl.bioontology.org/ontology/PDQ/CDR0000040324 PDQ LOOM
http://purl.jp/bio/4/id/200906001301045800 IOBC LOOM
http://purl.obolibrary.org/obo/ARO_3007314 ARO LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 EFO LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 DINTO LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 COVID-19 LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 NIFSTD LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 PHIPO LOOM
http://purl.obolibrary.org/obo/CHEBI_45081 ODNAE LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0030863 OCHV LOOM
http://purl.bioontology.org/ontology/VANDF/4019881 VANDF LOOM
http://www.drugbank.ca/drugs/DB00738 FTC LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000147966 ODAE LOOM
https://go.drugbank.com/drugs/DB00738 MDM LOOM
http://purl.bioontology.org/ontology/RXNORM/7994 RXNORM LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147966 NDFRT LOOM
http://purl.bioontology.org/ontology/CSP/0114-0900 CRISP LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C731 NCIT LOOM
http://purl.bioontology.org/ontology/MESH/D010419 MESH LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D010419 RH-MESH LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/372699006 SNOMEDCT LOOM
http://purl.obolibrary.org/obo/NCIT_C731 BERO LOOM
http://purl.obolibrary.org/obo/MESH_D010419 BERO LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.078.100.700 RH-MESH LOOM
http://purl.bioontology.org/ontology/RCD/x01JH RCD LOOM
http://www.phoc.org.cn/pmo/class/PMO_00015994 PMAPP-PMO LOOM
http://stirdf.jst.go.jp/id/200907024698542981 IOBC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#9436 OCHV LOOM