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(Q82805398)
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English
2-(Hexa-3,5-dien-1-YN-1-YL)-5-(prop-1-YN-1-YL)thiophene
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
198.05032132
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₀S
0 references
canonical SMILES
C(#CC=1SC(C#CC)=CC1)C=CC=C
0 references
found in taxon
Geigeria aspera
1 reference
stated in
New sesquiterpene lactones, geranyllinalol derivatives and other constituents from Geigeria species
Geigeria burkei
1 reference
stated in
New sesquiterpene lactones, geranyllinalol derivatives and other constituents from Geigeria species
Geigeria burkei var. burkei
1 reference
stated in
New sesquiterpene lactones, geranyllinalol derivatives and other constituents from Geigeria species
Rudbeckia hirta
2 references
stated in
Dithiacyclohexadienes and thiophenes of Rudbeckia hirta
stated in
Multiple modes of insecticidal action of three classes of polyacetylene derivatives from Rudbeckia hirta
Identifiers
InChI
InChI=1S/C13H10S/c1-3-5-6-7-9-13-11-10-12(14-13)8-4-2/h3,5-6,10-11H,1H2,2H3
0 references
InChIKey
BTXGXNRHWLHJBS-UHFFFAOYSA-N
0 references
CAS Registry Number
777-89-9
0 references
PubChem CID
71401707
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
BTXGXNRHWLHJBS-UHFFFAOYSA-N
UniChem compound ID
58291065
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10822730
1 reference
matched by identifier from
InChIKey
InChIKey
BTXGXNRHWLHJBS-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30773472
0 references
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