CHEBI:2866 - ascaridole

ChEBI IDCHEBI:2866
ChEBI Nameascaridole
Stars
DefinitionA p-menthane monoterpenoid that is p-menth-2-ene with a peroxy group across position 1 to 4.
Last Modified9 February 2015
DownloadsMolfile
FormulaC10H16O2
Net Charge0
Average Mass168.236
Monoisotopic Mass168.11503
SMILESCC(C)C12C=CC(C)(CC1)OO2
InChIInChI=1S/C10H16O2/c1-8(2)10-6-4-9(3,5-7-10)11-12-10/h4,6,8H,5,7H2,1-3H3
InChIKeyMGYMHQJELJYRQS-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
oxidising agent  A substance that removes electrons from another reactant in a redox reaction.
Biological Roles:
antileishmanial agent  An antiprotozoal drug used to treat or prevent infections caused by protozoan parasites that belong to the genus Leishmania.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Applications:
antileishmanial agent  An antiprotozoal drug used to treat or prevent infections caused by protozoan parasites that belong to the genus Leishmania.
antinematodal drug  A substance used in the treatment or control of nematode infestations.
ChEBI Ontology
Outgoing Relation(s)
ascaridole (CHEBI:2866) has role antileishmanial agent (CHEBI:70868)
ascaridole (CHEBI:2866) has role antinematodal drug (CHEBI:35444)
ascaridole (CHEBI:2866) has role plant metabolite (CHEBI:76924)
ascaridole (CHEBI:2866) is a p-menthane monoterpenoid (CHEBI:25186)
ascaridole (CHEBI:2866) is a organic heterobicyclic compound (CHEBI:27171)
ascaridole (CHEBI:2866) is a organic peroxide (CHEBI:25702)
IUPAC Name 
4-methyl-1-(propan-2-yl)-2,3-dioxabicyclo[2.2.2]oct-5-ene
Synonyms  Source
1,4-epidioxy-p-menth-2-eneChemIDplus
1,4-peroxido-p-menthene-2ChemIDplus
1,4-peroxy-p-menth-2-eneNIST Chemistry WebBook
1-isopropyl-4-methyl-2,3-dioxabicyclo[2.2.2]oct-5-eneNIST Chemistry WebBook
1-methyl-4-(1-methylethyl)-2,3-dioxabicyclo[2.2.2]oct-5-eneNIST Chemistry WebBook
AscaridoleKEGG COMPOUND
Manual XrefsDatabases
AscaridoleWikipedia
C00003027KNApSAcK
C09836KEGG COMPOUND
HMDB0035766HMDB
Registry NumbersSources
Reaxys:121382Reaxys
CAS:512-85-6NIST Chemistry WebBook
CAS:512-85-6ChemIDplus
CAS:512-85-6KEGG COMPOUND
Citations