CHEBI:88568 - 3,7-Dimethyl-2,6-octadien-1-ylacetate

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 3,7-Dimethyl-2,6-octadien-1-ylacetate ChEBI ID CHEBI:88568 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C12H20O2 Net Charge 0 Average Mass 196.286 Monoisotopic Mass 196.14633 InChI InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3 InChIKey HIGQPQRQIQDZMP-UHFFFAOYSA-N SMILES CC(C)=CCCC(C)=CCOC(C)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed ChEBI Ontology Outgoing 3,7-Dimethyl-2,6-octadien-1-ylacetate (CHEBI:88568) is a carboxylic ester (CHEBI:33308) Synonyms Sources 3,7-Dimethyl-2,6-octadien-1-ylacetic acid HMDB 3,7-dimethylocta-2,6-dien-1-yl acetate HMDB Manual Xref Database HMDB0061816 HMDB View more database links Citation Type Source 24421258 PubMed citation Europe PMC