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> Main
CHEBI:88912 - 2-methylfuran
Main
ChEBI Ontology
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ChEBI Name
2-methylfuran
ChEBI ID
CHEBI:88912
Definition
A member of the class of furans that is furan in which the hydrogen at position 2 is replaced by a methyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Read full article at Wikipedia
Formula
C5H6O
Net Charge
0
Average Mass
82.102
Monoisotopic Mass
82.04186
InChI
InChI=1S/C5H6O/c1-5-3-2-4-6-5/h2-4H,1H3
InChIKey
VQKFNUFAXTZWDK-UHFFFAOYSA-N
SMILES
CC1=CC=CO1
Metabolite of Species
Details
Citrus hystrix
(NCBI:txid170989)
See:
PubMed
Citrus limon
(NCBI:txid2708)
See:
PubMed
Prunus avium
(NCBI:txid42229)
See:
PubMed
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
Homo sapiens
(NCBI:txid9606)
Found in faeces
(UBERON:0001988)
. See:
PubMed
Roles Classification
Biological Role
(s):
hepatotoxic agent
A role played by a chemical compound exihibiting itself through the ability to induce damage to the liver in animals.
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
Application
(s):
fuel
An energy-rich substance that can be transformed with release of usable energy.
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-methylfuran (
CHEBI:88912
)
has role
flavouring agent (
CHEBI:35617
)
2-methylfuran (
CHEBI:88912
)
has role
fuel (
CHEBI:33292
)
2-methylfuran (
CHEBI:88912
)
has role
hepatotoxic agent (
CHEBI:50908
)
2-methylfuran (
CHEBI:88912
)
has role
human urinary metabolite (
CHEBI:84087
)
2-methylfuran (
CHEBI:88912
)
has role
plant metabolite (
CHEBI:76924
)
2-methylfuran (
CHEBI:88912
)
is a
furans (
CHEBI:24129
)
2-methylfuran (
CHEBI:88912
)
is a
volatile organic compound (
CHEBI:134179
)
IUPAC Name
2-methylfuran
Synonyms
Sources
2-methyl furan
ChEBI
2-methyl-furan
HMDB
2-methylfurane
NIST Chemistry WebBook
2-MF
ChEBI
5-methylfuran
ChemIDplus
α-methylfuran
ChemIDplus
silvan
ChemIDplus
sylvan
ChemIDplus
Manual Xrefs
Databases
10340
ChemSpider
2-Methylfuran
Wikipedia
C00048276
KNApSAcK
FDB012718
FooDB
HMDB0013749
HMDB
View more database links
Registry Numbers
Types
Sources
103733
Reaxys Registry Number
Reaxys
534-22-5
CAS Registry Number
NIST Chemistry WebBook
534-22-5
CAS Registry Number
ChemIDplus
Citations
Types
Sources
19747702
PubMed citation
Europe PMC
22284503
PubMed citation
Europe PMC
23454028
PubMed citation
Europe PMC
23694923
PubMed citation
Europe PMC
27120138
PubMed citation
Europe PMC
28165200
PubMed citation
Europe PMC
29219310
PubMed citation
Europe PMC
29451290
PubMed citation
Europe PMC
30036056
PubMed citation
Europe PMC
30620016
PubMed citation
Europe PMC
31314520
PubMed citation
Europe PMC
31332529
PubMed citation
Europe PMC
31472386
PubMed citation
Europe PMC
31875825
PubMed citation
Europe PMC
31970347
PubMed citation
Europe PMC
32660823
PubMed citation
Europe PMC
33153167
PubMed citation
Europe PMC
33319365
PubMed citation
Europe PMC
IND605263906
Agricola citation
Europe PMC
Last Modified
20 May 2021