loading...| Preferred Name |
pentamidine |
| Synonyms |
1,5-bis(4-amidinophenoxy)pentane pentamidine 4,4'-(1,5-pentanediylbis(oxy))bis-benzenecarboximidamide 4,4'-(pentamethylenedioxy)dibenzamidine 4,4'-Diamidinodiphenoxypentane pentamidin 4,4'-[pentane-1,5-diylbis(oxy)]dibenzenecarboximidamide Pentamidine p,p'-(pentamethylenedioxy)dibenzamidine |
| 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A diether consisting of pentane-1,5-diol in which both hydroxyl hydrogens have been replaced by 4-amidinophenyl groups.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 |
Beilstein:3159790 PMID:27011917 PMID:7690919 PMID:27357655 Patent:EP975608 PMID:20144237 PMID:28167598 PMID:22327112 PMID:26418240 Patent:US2394003 PMID:11584934 PMID:26903605 Patent:GB507565 PMID:26824946 HMDB:HMDB0014876 PMID:26052915 PMID:26117647 PMID:18346045 PMID:26606757 PMID:10917591 Patent:US2008214569 PMID:11438428 PMID:14603035 Wikipedia:Pentamidine PMID:26938448 LINCS:LSM-4540 PMID:18971316 Reaxys:3159790 Patent:US7115665 PMID:15711592 PMID:27297108 Patent:US2008167296 PDBeChem:PNT PMID:27164533 PMID:22046004 PMID:8841838 PMID:26431253 KEGG:C07420 PMID:27135970 PMID:26344166 PMID:26828608 PMID:7542607 PMID:20599360 CAS:100-33-4 PMID:27729250 PMID:28263303 PMID:28074607 PMID:26515653 PMID:26295040 Patent:US2006235001 PMID:26882015 PMID:27214074 PMID:22093811 PMID:26648589 Drug_Central:2090 PMID:27600039 PMID:19966562 KEGG:D08333 PMID:26734860 PMID:27353022 PMID:10415905 DrugBank:DB00738 PMID:22200378 |
| 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A diether consisting of pentane-1,5-diol in which both hydroxyl hydrogens have been replaced by 4-amidinophenyl groups.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_76395 http://purl.obolibrary.org/obo/CHEBI_63673 http://purl.obolibrary.org/obo/CHEBI_36335 http://purl.obolibrary.org/obo/CHEBI_136651 http://purl.obolibrary.org/obo/CHEBI_60643 http://purl.obolibrary.org/obo/CHEBI_130181 |
| 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 pentamidine 4,4'-(1,5-pentanediylbis(oxy))bis-benzenecarboximidamide 4,4'-(pentamethylenedioxy)dibenzamidine 4,4'-Diamidinodiphenoxypentane pentamidin p,p'-(pentamethylenedioxy)dibenzamidine |
| id |
CHEBI:45081 |
| in_subset | |
| 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 | |
| label |
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 |
| treeView |
http://purl.obolibrary.org/obo/CHEBI_35618 |
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_35618 |