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CHEBI:67883 - rel-(2R/S,4R,5R)-4-ethyl-5-methyl-2-(1-methylethyl)-1,3-dioxolane

ChEBI IDCHEBI:67883
ChEBI Namerel-(2R/S,4R,5R)-4-ethyl-5-methyl-2-(1-methylethyl)-1,3-dioxolane
Stars
DefinitionA natural product found in Triatoma brasiliensis and Triatoma infestans.
Last Modified22 September 2014
DownloadsMolfile
FormulaC9H18O2
Net Charge0
Average Mass158.241
Monoisotopic Mass158.13068
SMILESCC[C@H]1OC(C(C)C)O[C@@H]1C
InChIInChI=1S/C9H18O2/c1-5-8-7(4)10-9(11-8)6(2)3/h6-9H,5H2,1-4H3/t7-,8-,9?/m1/s1
InChIKeyJCMYCHKAJWEBQB-ZAZKALAHSA-N
Species of MetaboliteComponentSourceComments
Triatoma brasiliensis (ncbitaxon:65344) gland (BTO:0000522) PubMed (21486009) Trans compound isolated from metasternal glands
Triatoma infestans (ncbitaxon:30076) gland (BTO:0000522) PubMed (21486009) metasternal glands
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
rel-(2R/S,4R,5R)-4-ethyl-5-methyl-2-(1-methylethyl)-1,3-dioxolane (CHEBI:67883) has role metabolite (CHEBI:25212)
rel-(2R/S,4R,5R)-4-ethyl-5-methyl-2-(1-methylethyl)-1,3-dioxolane (CHEBI:67883) is a dioxolane (CHEBI:39430)
Citations