BioModels Ontology

Last uploaded: April 3, 2012
Preferred Name

eletriptan

Synonyms
Definitions

Eletriptan is an N-alkylpyrrolidine, being N-methylpyrrolidine in which the pro-R hydrogen at position 2 is substituted by a {5-[2-(phenylsulfonyl)ethyl]-1H-indol-3-yl}methyl group.

ID

http://purl.obolibrary.org/obo/CHEBI_50922

alternative term

InChI=1S/C22H26N2O2S/c1-24-12-5-6-19(24)15-18-16-23-22-10-9-17(14-21(18)22)11-13-27(25,26)20-7-3-2-4-8-20/h2-4,7-10,14,16,19,23H,5-6,11-13,15H2,1H3/t19-/m1/s1

eletriptanum

CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12

C22H26N2O2S

3-{[(2R)-1-methylpyrrolidin-2-yl]methyl}-5-[2-(phenylsulfonyl)ethyl]-1H-indole

eletriptan

InChIKey=PWVXXGRKLHYWKM-LJQANCHMSA-N

definition

Eletriptan is an N-alkylpyrrolidine, being N-methylpyrrolidine in which the pro-R hydrogen at position 2 is substituted by a {5-[2-(phenylsulfonyl)ethyl]-1H-indol-3-yl}methyl group.

has role

http://purl.obolibrary.org/obo/CHEBI_35941

http://purl.obolibrary.org/obo/CHEBI_35475

http://purl.obolibrary.org/obo/CHEBI_50514

is conjugate base of

http://purl.obolibrary.org/obo/CHEBI_61177

label

eletriptan

prefixIRI

CHEBI:50922

prefLabel

eletriptan

subClassOf

http://purl.obolibrary.org/obo/CHEBI_35850

http://purl.obolibrary.org/obo/CHEBI_24828

http://purl.obolibrary.org/obo/CHEBI_46775

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http://purl.obolibrary.org/obo/CHEBI_50922 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50922 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50922 DINTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50922 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50922 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50922 CHEBI LOOM
http://purl.obolibrary.org/obo/DRON_00013763 ODNAE LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C115647 RH-MESH LOOM
http://www.drugbank.ca/drugs/DB00216 FTC LOOM
http://purl.bioontology.org/ontology/RXNORM/231049 RXNORM LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C65509 NCIT LOOM
http://purl.jp/bio/4/id/200906028742214808 IOBC LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000148791 NDFRT LOOM
http://purl.bioontology.org/ontology/MESH/C115647 MESH LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000148791 ODAE LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#48611 OCHV LOOM
http://purl.bioontology.org/ontology/ATC/N02CC06 ATC LOOM
http://purl.bioontology.org/ontology/VANDF/4021372 VANDF LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0759933 OCHV LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/410843003 SNOMEDCT LOOM
http://stirdf.jst.go.jp/id/200907015439473379 IOBC LOOM
https://go.drugbank.com/drugs/DB00216 MDM LOOM
http://purl.bioontology.org/ontology/NDDF/009521 NDDF LOOM
http://purl.obolibrary.org/obo/CHEBI_50922 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_50922 DINTO LOOM
http://purl.obolibrary.org/obo/CHEBI_50922 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_50922 DRON LOOM
http://www.phoc.org.cn/pmo/class/PMO_00026597 PMAPP-PMO LOOM
http://purl.obolibrary.org/obo/NCIT_C65509 BERO LOOM