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:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
antileishmanial agent  An antiprotozoal drug used to treat or prevent infections caused by protozoan parasites that belong to the genus Leishmania.
Applications:
antinematodal drug  A substance used in the treatment or control of nematode infestations.
antileishmanial agent  An antiprotozoal drug used to treat or prevent infections caused by protozoan parasites that belong to the genus Leishmania.
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
AscaridoleKEGG COMPOUND
1-isopropyl-4-methyl-2,3-dioxabicyclo[2.2.2]oct-5-eneNIST Chemistry WebBook
1,4-peroxy-p-menth-2-eneNIST Chemistry WebBook
1,4-epidioxy-p-menth-2-eneChemIDplus
1-methyl-4-(1-methylethyl)-2,3-dioxabicyclo[2.2.2]oct-5-eneNIST Chemistry WebBook
1,4-peroxido-p-menthene-2ChemIDplus
Manual XrefsDatabases
C09836KEGG COMPOUND
C00003027KNApSAcK
AscaridoleWikipedia
HMDB0035766HMDB
Registry NumbersSources
Reaxys:121382Reaxys
CAS:512-85-6KEGG COMPOUND
CAS:512-85-6NIST Chemistry WebBook
CAS:512-85-6ChemIDplus
Citations