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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:131334 - 2-(6-heptynyl)-1,3-dioxolane
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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.
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This entity has been manually annotated by the ChEBI Team.
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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
View more database links
Last Modified
27 July 2016