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CHEBI:59445 - chlormerodrin

Default Structure
ChEBI IDCHEBI:59445
ChEBI Namechlormerodrin
Stars
DefinitionUrea in which one of the hydrogens is substituted by a 3-chloromercury-2-methoxyprop-1-yl group. It was formerly used as a diuretic, but more potent and less toxic drugs are now available. Its radiolabelled (197Hg, 203Hg) forms were used in diagnostic aids in renal imaging and brain scans.
Last Modified17 July 2012
SubmitterGareth Owen
DownloadsMolfile
FormulaC5H11ClHgN2O2
Net Charge0
Average Mass367.198
Monoisotopic Mass368.02155
SMILESCOC(CNC(N)=O)[CH2][Hg][Cl]
InChIInChI=1S/C5H11N2O2.ClH.Hg/c1-4(9-2)3-7-5(6)8;;/h4H,1,3H2,2H3,(H3,6,7,8);1H;/q;;+1/p-1
InChIKeyBJFGVYCULWBXKF-UHFFFAOYSA-M
Roles Classification
Applications:
diagnostic agent  A substance administered to aid diagnosis of a disease.
diuretic  An agent that promotes the excretion of urine through its effects on kidney function.
ChEBI Ontology
Outgoing Relation(s)
chlormerodrin (CHEBI:59445) has role diagnostic agent (CHEBI:33295)
chlormerodrin (CHEBI:59445) has role diuretic (CHEBI:35498)
chlormerodrin (CHEBI:59445) is a organic molecular entity (CHEBI:50860)
chlormerodrin (CHEBI:59445) is a organomercury compound (CHEBI:25706)
chlormerodrin (CHEBI:59445) is a racemate (CHEBI:60911)
chlormerodrin (CHEBI:59445) is a ureas (CHEBI:47857)
Incoming Relation(s)
chlormerodrin (197Hg) (CHEBI:59455) is a chlormerodrin (CHEBI:59445)
chlormerodrin (203Hg) (CHEBI:59462) is a chlormerodrin (CHEBI:59445)
IUPAC Name 
[3-(carbamoylamino)-2-methoxypropyl](chloro)mercury
INNs  Source
chlormerodrinChemIDplus
chlormerodrinaChemIDplus
chlormerodrineChemIDplus
chlormerodrinumChemIDplus
clormerodrinaWHO MedNet
Synonyms  Source
1-[3-(chloromercuri)-2-methoxypropyl]ureaChemIDplus
{3-[(aminocarbonyl)amino]-2-methoxypropyl}chloromercuryChemIDplus
NSC-19911ChEMBL
Brand Names  Source
MercloranChEMBL
NeohydrinChEMBL
Manual XrefsDatabases
DB00534DrugBank
US2635982Patent
US2635983Patent
Registry NumbersSources
Beilstein:3735455Beilstein
CAS:62-37-3ChemIDplus