CHEBI:81989 - ethirimol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ethirimol
ChEBI ID CHEBI:81989
Definition An aminopyrimidine that is 2-ethylaminopyrimidin-4-one carrying butyl and methyl substituents at positions 5 and 6 respectively. A fungicide first marketed in 1970 and used as a seed treatment for diseaases such as damping-off, it is not licensed for use within the European Union.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C11H19N3O
Net Charge 0
Average Mass 209.28810
Monoisotopic Mass 209.15281
InChI InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)
InChIKey BBXXLROWFHWFQY-UHFFFAOYSA-N
SMILES CCCCc1c(C)[nH]c(NCC)nc1=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): antifungal agrochemical
Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
fungicide
A substance used to destroy fungal pests.
(via pyrimidine fungicide )
antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
(via pyrimidine antifungal agent )
Application(s): antifungal agrochemical
Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
fungicide
A substance used to destroy fungal pests.
(via pyrimidine fungicide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ethirimol (CHEBI:81989) has role antifungal agrochemical (CHEBI:86328)
ethirimol (CHEBI:81989) is a aminopyrimidine (CHEBI:38338)
ethirimol (CHEBI:81989) is a pyrimidine fungicide (CHEBI:87207)
ethirimol (CHEBI:81989) is a pyrimidone (CHEBI:38337)
ethirimol (CHEBI:81989) is a secondary amino compound (CHEBI:50995)
IUPAC Name
5-butyl-2-(ethylamino)-6-methylpyrimidin-4(1H)-one
Synonyms Sources
2-Ethylamino-4-methyl-5-n-butyl-6-hydroxypyrimidine ChemIDplus
5-Butyl-2-(ethylamino)-6-methyl-4(1H)-pyrimidinone ChemIDplus
5-Butyl-2-(ethylamino)-6-methyl-4-pyrimidinol ChemIDplus
5-n-Butyl-2-ethylamino-4-hydroxy-6-methylpyrimidine ChemIDplus
Manual Xrefs Databases
277 PPDB
C18828 KEGG COMPOUND
CN101548677 Patent
CN101664033 Patent
CN101669475 Patent
DE3715705 Patent
ethirimol Alan Wood's Pesticides
View more database links
Registry Numbers Types Sources
1572438 Reaxys Registry Number Reaxys
23947-60-6 CAS Registry Number NIST Chemistry WebBook
23947-60-6 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
11407590 PubMed citation Europe PMC
18944340 PubMed citation Europe PMC
4833650 PubMed citation Europe PMC
4927739 PubMed citation Europe PMC
IND43747567 Agricola citation Europe PMC
IND81011071 Agricola citation Europe PMC
Last Modified
29 July 2015