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CHEBI:81952 - bupirimate

ChEBI IDCHEBI:81952
ChEBI Namebupirimate
Stars
DefinitionA member of the class of aminopyrimidines that is 2-ethylaminopyrimidine carrying methyl, butyl and dimethylaminosulfooxy substituents at posiitons 4, 5 and 6 respectively.
Last Modified29 July 2015
DownloadsMolfile
FormulaC13H24N4O3S
Net Charge0
Average Mass316.427
Monoisotopic Mass316.15691
SMILESCCCCc1c(C)nc(NCC)nc1OS(=O)(=O)N(C)C
InChIInChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)
InChIKeyDSKJPMWIHSOYEA-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
androgen antagonist  A compound which inhibits or antagonises the biosynthesis or actions of androgens.
antifungal agrochemical  Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
fungicide  A substance used to destroy fungal pests.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
Applications:
androgen antagonist  A compound which inhibits or antagonises the biosynthesis or actions of androgens.
antifungal agrochemical  Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
fungicide  A substance used to destroy fungal pests.
ChEBI Ontology
Outgoing Relation(s)
bupirimate (CHEBI:81952) has role androgen antagonist (CHEBI:35497)
bupirimate (CHEBI:81952) has role antifungal agrochemical (CHEBI:86328)
bupirimate (CHEBI:81952) is a aminopyrimidine (CHEBI:38338)
bupirimate (CHEBI:81952) is a pyrimidine fungicide (CHEBI:87207)
bupirimate (CHEBI:81952) is a secondary amino compound (CHEBI:50995)
bupirimate (CHEBI:81952) is a sulfamate ester (CHEBI:48199)
IUPAC Name 
5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate
Synonyms  Source
Dimethylsulfamic acid 5-butyl-2-(ethylamino)-6-methyl-4-pyrimidinyl esterChemIDplus
5-Butyl-2-(ethylamino)-6-methyl-4-pyrimidinyl dimethylsulfamateChemIDplus
5-Butyl-2-ethylamino-6-methylpyrimidin-4-yl dimethylsulphamateChemIDplus
2-Äthylamino-5-butyl-4-yl-dimethylsulfamatChemIDplus
Manual XrefsDatabases
C18776KEGG COMPOUND
BupirimateWikipedia
CN101647443Patent
DE3441674Patent
GB2112287Patent
CN101647442Patent
CN101617658Patent
CN101632364Patent
CN101632374Patent
bupirimateAlan Wood's Pesticides
99PPDB
Registry NumbersSources
Reaxys:758056Reaxys
CAS:41483-43-6KEGG COMPOUND
CAS:41483-43-6ChemIDplus
Citations