The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

quinupristin

Synonyms

C53H67N9O10S

N-[(3S,6S,12R,15S,16R,19S)-25-{[(3S)-1-azabicyclo[2.2.2]octan-3-ylsulfanyl]methyl}-3-{[4-(dimethylamino)phenyl]methyl}-12-ethyl-4,16-dimethyl-2,5,11,14,18,21,24-heptaoxo-19-phenyl-17-oxa-1,4,10,13,20-pentaazatricyclo[20.4.0.0^{6,10}]hexacosan-15-yl]-3-hydroxypyridine-2-carboxamide

ID

http://purl.obolibrary.org/obo/dinto_DB01369

CASRN

120138-50-3

Definition

Quinupristin/dalfopristin is a combination of two antibiotics used to treat infections by staphylococci and by vancomycin-resistant Enterococcus faecium. Dalfopristin inhibits the early phase of protein synthesis in the bacterial ribosome and quinupristin inhibits the late phase of protein synthesis. The combination of the two components acts synergistically and is more effective in vitro than each component alone.

has pharmacological target

http://purl.obolibrary.org/obo/dinto_2448

http://purl.obolibrary.org/obo/dinto_2752

http://purl.obolibrary.org/obo/dinto_2857

InChI

InChI=1S/C53H67N9O10S/c1-6-37-50(68)61-23-11-14-38(61)51(69)59(5)40(26-32-16-18-36(19-17-32)58(3)4)52(70)62-28-35(30-73-43-29-60-24-20-33(43)21-25-60)42(64)27-39(62)47(65)57-45(34-12-8-7-9-13-34)53(71)72-31(2)44(48(66)55-37)56-49(67)46-41(63)15-10-22-54-46/h7-10,12-13,15-19,22,31,33,35,37-40,43-45,63H,6,11,14,20-21,23-30H2,1-5H3,(H,55,66)(H,56,67)(H,57,65)/t31-,35?,37-,38+,39?,40+,43-,44+,45+/m1/s1

InChIKey

InChIKey=WTHRRGMBUAHGNI-MJWHERSYSA-N

inhibits

http://purl.obolibrary.org/obo/dinto_0901

http://purl.obolibrary.org/obo/dinto_2448

http://purl.obolibrary.org/obo/dinto_2752

http://purl.obolibrary.org/obo/dinto_2857

label

quinupristin

may interact with

http://purl.obolibrary.org/obo/dinto_DB01346

http://purl.obolibrary.org/obo/dinto_DB00401

http://purl.obolibrary.org/obo/CHEBI_49575

http://purl.obolibrary.org/obo/CHEBI_8707

http://purl.obolibrary.org/obo/CHEBI_5280

http://purl.obolibrary.org/obo/dinto_DB01320

http://purl.obolibrary.org/obo/dinto_DB00503

http://purl.obolibrary.org/obo/dinto_DB00199

http://purl.obolibrary.org/obo/dinto_DB00224

http://purl.obolibrary.org/obo/CHEBI_3732

http://purl.obolibrary.org/obo/CHEBI_9943

http://purl.obolibrary.org/obo/CHEBI_2896

http://purl.obolibrary.org/obo/CHEBI_480999

http://purl.obolibrary.org/obo/CHEBI_6441

http://purl.obolibrary.org/obo/CHEBI_4911

http://purl.obolibrary.org/obo/CHEBI_585948

http://purl.obolibrary.org/obo/dinto_DB01341

http://purl.obolibrary.org/obo/CHEBI_63611

http://purl.obolibrary.org/obo/dinto_DB01218

http://purl.obolibrary.org/obo/CHEBI_6456

http://purl.obolibrary.org/obo/CHEBI_36373

http://purl.obolibrary.org/obo/dinto_DB00691

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

http://purl.obolibrary.org/obo/CHEBI_4672

http://purl.obolibrary.org/obo/CHEBI_61049

http://purl.obolibrary.org/obo/dinto_DB00570

http://purl.obolibrary.org/obo/dinto_DB00528

http://purl.obolibrary.org/obo/dinto_DB00104

http://purl.obolibrary.org/obo/CHEBI_9948

http://purl.obolibrary.org/obo/CHEBI_4717

http://purl.obolibrary.org/obo/CHEBI_3720

http://purl.obolibrary.org/obo/CHEBI_41774

http://purl.obolibrary.org/obo/CHEBI_3558

http://purl.obolibrary.org/obo/CHEBI_4681

http://purl.obolibrary.org/obo/CHEBI_3387

http://purl.obolibrary.org/obo/CHEBI_119573

http://purl.obolibrary.org/obo/CHEBI_75988

http://purl.obolibrary.org/obo/CHEBI_127780

http://purl.obolibrary.org/obo/CHEBI_2668

http://purl.obolibrary.org/obo/CHEBI_28593

http://purl.obolibrary.org/obo/dinto_DB00541

http://purl.obolibrary.org/obo/dinto_DB00342

http://purl.obolibrary.org/obo/CHEBI_45863

http://purl.obolibrary.org/obo/CHEBI_39548

http://purl.obolibrary.org/obo/CHEBI_40303

http://purl.obolibrary.org/obo/CHEBI_6541

http://purl.obolibrary.org/obo/CHEBI_63613

http://purl.obolibrary.org/obo/dinto_DB00622

http://purl.obolibrary.org/obo/CHEBI_7565

http://purl.obolibrary.org/obo/CHEBI_4031

http://purl.obolibrary.org/obo/dinto_DB00683

http://purl.obolibrary.org/obo/CHEBI_9150

http://purl.obolibrary.org/obo/dinto_DB00365

http://purl.obolibrary.org/obo/CHEBI_4657

http://purl.obolibrary.org/obo/CHEBI_6888

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

http://purl.obolibrary.org/obo/CHEBI_75984

http://purl.obolibrary.org/obo/CHEBI_9011

http://purl.obolibrary.org/obo/dinto_DB00270

http://purl.obolibrary.org/obo/CHEBI_4995

http://purl.obolibrary.org/obo/CHEBI_7575

http://purl.obolibrary.org/obo/CHEBI_63598

http://purl.obolibrary.org/obo/CHEBI_63629

http://purl.obolibrary.org/obo/CHEBI_30621

prefixIRI

obo2:dinto_DB01369

prefLabel

quinupristin

SMILES

CC[C@H]1NC(=O)[C@@H](NC(=O)C2=NC=CC=C2O)[C@@H](C)OC(=O)[C@@H](NC(=O)C2CC(=O)C(CS[C@@H]3CN4CCC3CC4)CN2C(=O)[C@H](CC2=CC=C(C=C2)N(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O)C1=CC=CC=C1

Synonym

C53H67N9O10S

N-[(3S,6S,12R,15S,16R,19S)-25-{[(3S)-1-azabicyclo[2.2.2]octan-3-ylsulfanyl]methyl}-3-{[4-(dimethylamino)phenyl]methyl}-12-ethyl-4,16-dimethyl-2,5,11,14,18,21,24-heptaoxo-19-phenyl-17-oxa-1,4,10,13,20-pentaazatricyclo[20.4.0.0^{6,10}]hexacosan-15-yl]-3-hydroxypyridine-2-carboxamide

xref

Wikipedia:http://en.wikipedia.org/wiki/Quinupristin

PharmGKB:PA164749647

PDB:SYB

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

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http://purl.obolibrary.org/obo/ARO_3000584 ARO LOOM
http://purl.obolibrary.org/obo/ARO_3000584 ARO LOOM
http://purl.obolibrary.org/obo/ARO_3000584 ARO LOOM
http://purl.bioontology.org/ontology/MESH/C113825 MESH LOOM
http://purl.bioontology.org/ontology/VANDF/4021184 VANDF LOOM
http://purl.obolibrary.org/obo/CHEBI_8732 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_8732 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_8732 GENEPIO LOOM
http://purl.obolibrary.org/obo/CHEBI_8732 CHEBI LOOM
http://purl.obolibrary.org/obo/DRON_00012969 DRON LOOM
http://purl.obolibrary.org/obo/DRON_00012969 DRON LOOM
http://purl.obolibrary.org/obo/DRON_00012969 DRON LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0756081 OCHV LOOM
http://www.co-ode.org/ontologies/galen#Quinupristin GALEN LOOM
http://purl.obolibrary.org/obo/DDO.owl#DDO_0006118 DDO LOOM
http://purl.obolibrary.org/obo/DDO.owl#DDO_0006118 DMTO LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000148631 NDFRT LOOM
http://purl.obolibrary.org/obo/DDO.owl#DDO_0006121 FASTO LOOM
http://purl.obolibrary.org/obo/DDO.owl#DDO_0006121 DDO LOOM
http://purl.obolibrary.org/obo/DDO.owl#DDO_0006121 DMTO LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/387015002 SNOMEDCT LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#48597 OCHV LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C47701 NCIT LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C47701 NCIT LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C47701 NCIT LOOM
http://purl.bioontology.org/ontology/RXNORM/229367 RXNORM LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C113825 RH-MESH LOOM
http://purl.bioontology.org/ontology/NDDF/007887 NDDF LOOM