CHEBI:131334 - 2-(6-heptynyl)-1,3-dioxolane

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-(6-heptynyl)-1,3-dioxolane
ChEBI ID CHEBI:131334
Definition A member of the class of dioxolanes that is 1,3-dioxolane substituted at position 2 by a 6-heptynyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C10H16O2
Net Charge 0
Average Mass 168.233
Monoisotopic Mass 168.11503
InChI InChI=1S/C10H16O2/c1-2-3-4-5-6-7-10-11-8-9-12-10/h1,10H,3-9H2
InChIKey WVBSSCMKXLECHD-UHFFFAOYSA-N
SMILES O1C(OCC1)CCCCCC#C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: PubMed
Homo sapiens (NCBI:txid9606) See: MetaboLights Study
ChEBI Ontology
Outgoing 2-(6-heptynyl)-1,3-dioxolane (CHEBI:131334) has parent hydride 1,3-dioxolane (CHEBI:87597)
2-(6-heptynyl)-1,3-dioxolane (CHEBI:131334) is a cyclic acetal (CHEBI:59770)
2-(6-heptynyl)-1,3-dioxolane (CHEBI:131334) is a dioxolane (CHEBI:39430)
2-(6-heptynyl)-1,3-dioxolane (CHEBI:131334) is a terminal acetylenic compound (CHEBI:73477)
IUPAC Name
2-(hept-6-yn-1-yl)-1,3-dioxolane
Manual Xref Database
480281 ChemSpider
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Last Modified
27 July 2016