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,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
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ChEBI
> Main
CHEBI:156100 - (
E
)-2-pentenal
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ChEBI Name
(
E
)-2-pentenal
ChEBI ID
CHEBI:156100
ChEBI ASCII Name
(E)-2-pentenal
Definition
A 2-pentenal in which the double bond has (
E
)-configuration. It is found in cigarette smoke, virgin olive oil, and milk.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Anne Morgat
Supplier Information
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Molfile
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Molfile
Formula
C5H8O
Net Charge
0
Average Mass
84.118
Monoisotopic Mass
84.05751
InChI
InChI=1S/C5H8O/c1-2-3-4-5-6/h3-5H,2H2,1H3/b4-3+
InChIKey
DTCCTIQRPGSLPT-ONEGZZNKSA-N
SMILES
C(/C=C/CC)(=O)[H]
Metabolite of Species
Details
Ruditapes philippinarum
(NCBI:txid129788)
See:
PubMed
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(
E
)-2-pentenal (
CHEBI:156100
)
has role
plant metabolite (
CHEBI:76924
)
(
E
)-2-pentenal (
CHEBI:156100
)
is a
2-pentenal (
CHEBI:61722
)
IUPAC Name
(2
E
)-pent-2-enal
Synonyms
Sources
(
E
)-2-pentenal
UniProt
(
E
)-pent-2-en-1-al
ChemIDplus
(
E
)-pent-2-enal
NIST Chemistry WebBook
2-(
E
)-pentenal
ChemIDplus
trans
-2-penten-1-al
NIST Chemistry WebBook
trans
-2-pentenal
ChemIDplus
trans
-pent-2-enal
NIST Chemistry WebBook
Manual Xrefs
Databases
CPD-13228
MetaCyc
FDB008234
FooDB
View more database links
Registry Numbers
Types
Sources
1576-87-0
CAS Registry Number
ChemIDplus
1576-87-0
CAS Registry Number
NIST Chemistry WebBook
1719742
Reaxys Registry Number
Reaxys
Citations
Types
Sources
21169366
PubMed citation
SUBMITTER
27322490
PubMed citation
Europe PMC
27566362
PubMed citation
Europe PMC
29374187
PubMed citation
Europe PMC
30409573
PubMed citation
Europe PMC
31474722
PubMed citation
Europe PMC
31620117
PubMed citation
Europe PMC
31655477
PubMed citation
Europe PMC
32123512
PubMed citation
Europe PMC
32242562
PubMed citation
Europe PMC
Last Modified
13 July 2020