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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:168930 - 2-[(ethylthio)methyl]furan
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ChEBI Name
2-[(ethylthio)methyl]furan
ChEBI ID
CHEBI:168930
Definition
A member of the class of furans that is furan substituted by an (ethylsulfanyl)methyl group at position 2.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
MetaboLights
Supplier Information
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Molfile
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Molfile
Formula
C7H10OS
Net Charge
0
Average Mass
142.220
Monoisotopic Mass
142.04524
InChI
InChI=1S/C7H10OS/c1-2-9-6-7-4-3-5-8-7/h3-5H,2,6H2,1H3
InChIKey
WGQJSONNMGREEA-UHFFFAOYSA-N
SMILES
CCSCC1=CC=CO1
Metabolite of Species
Details
Coffea arabica
(NCBI:txid13443)
See:
PubMed
Malus domestica
(NCBI:txid3750)
Found in exocarp
(BTO:0000733)
. of strain Malus x domestica Borkh. cv. Ruixue See:
MetaboLights Study
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
Application
(s):
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2-[(ethylthio)methyl]furan (
CHEBI:168930
)
has role
flavouring agent (
CHEBI:35617
)
2-[(ethylthio)methyl]furan (
CHEBI:168930
)
has role
plant metabolite (
CHEBI:76924
)
2-[(ethylthio)methyl]furan (
CHEBI:168930
)
is a
furans (
CHEBI:24129
)
2-[(ethylthio)methyl]furan (
CHEBI:168930
)
is a
organic sulfide (
CHEBI:16385
)
IUPAC Name
2-[(ethylsulfanyl)methyl]furan
Synonyms
Sources
(furfurylthio)ethane
NIST Chemistry WebBook
ethyl furfuryl sulfide
ChEBI
furfuryl ethyl sulfide
NIST Chemistry WebBook
Manual Xrefs
Databases
453366
ChemSpider
FDB019534
FooDB
HMDB0039875
HMDB
View more database links
Registry Number
Type
Source
2024-70-6
CAS Registry Number
NIST Chemistry WebBook
Citations
Types
Sources
33315148
PubMed citation
Europe PMC
33552301
PubMed citation
Europe PMC
Last Modified
18 June 2021