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Details

Stereochemistry ACHIRAL
Molecular Formula C17H17FN4O
Molecular Weight 312.3415
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LUROSETRON

SMILES

CN1C2=C(C3=C1C(F)=CC=C3)C(=O)N(CC4=C(C)NC=N4)CC2

InChI

InChIKey=NUMKWGDDRWJQMY-UHFFFAOYSA-N
InChI=1S/C17H17FN4O/c1-10-13(20-9-19-10)8-22-7-6-14-15(17(22)23)11-4-3-5-12(18)16(11)21(14)2/h3-5,9H,6-8H2,1-2H3,(H,19,20)

HIDE SMILES / InChI
Lurosetron (GR 87442) is a serotonin 5HT3 receptor antagonist. It was undergoing clinical evaluation with Glaxo Wellcome in the UK as a potential drug for the treatment of emesis.

Approval Year

PubMed

PubMed

TitleDatePubMed
The metabolism of the 5HT3 antagonists ondansetron, alosetron and GR87442 I: a comparison of in vitro and in vivo metabolism and in vitro enzyme kinetics in rat, dog and human hepatocytes, microsomes and recombinant human enzymes.
2007 Aug
The metabolism of the 5HT3 antagonists, ondansetron, alosetron and GR87442 II: investigation into the in vitro methods used to predict the in vivo hepatic clearance of ondansetron, alosetron and GR87442 in the rat, dog and human.
2007 Aug
Name Type Language
LUROSETRON
INN  
INN  
Official Name English
lurosetron [INN]
Common Name English
GR-87442
Code English
1H-PYRIDO(4,3-B)INDOL-1-ONE, 6-FLUORO-2,3,4,5-TETRAHYDRO-5-METHYL-2-((5-METHYL-1H-IMIDAZOL-4-YL)METHYL)-
Systematic Name English
6-FLUORO-2,3,4,5-TETRAHYDRO-5-METHYL-2-((5-METHYLIMIDAZOL-4-YL)METHYL)-1H-PYRIDO(4,3-B)INDOL-1-ONE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C94726
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
Code System Code Type Description
SMS_ID
100000082273
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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CAS
128486-54-4
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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INN
7096
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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ChEMBL
CHEMBL2105137
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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EVMPD
SUB08621MIG
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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NCI_THESAURUS
C83896
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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WIKIPEDIA
LUROSETRON
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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PUBCHEM
172999
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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FDA UNII
G694G740ZP
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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EPA CompTox
DTXSID30155911
Created by admin on Fri Dec 15 16:52:32 GMT 2023 , Edited by admin on Fri Dec 15 16:52:32 GMT 2023
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