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ChEBI
> Main
CHEBI:87267 - (2
E
)-1,4-dimethoxybut-2-en-1-yl acetate
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ChEBI Name
(2
E
)-1,4-dimethoxybut-2-en-1-yl acetate
ChEBI ID
CHEBI:87267
ChEBI ASCII Name
(2E)-1,4-dimethoxybut-2-en-1-yl acetate
Definition
An olefinic compound that is but-2-en-1-yl acetate substituted by methoxy groups at positions 1 and 4 respectively.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C8H14O4
Net Charge
0
Average Mass
174.19440
Monoisotopic Mass
174.08921
InChI
InChI=1S/C8H14O4/c1-7(9)12-8(11-3)5-4-6-10-2/h4-5,8H,6H2,1-3H3/b5-4+
InChIKey
GAKZYUOVCHCSBU-SNAWJCMRSA-N
SMILES
COC\C=C\C(OC)OC(C)=O
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(2
E
)-1,4-dimethoxybut-2-en-1-yl acetate (
CHEBI:87267
)
has role
metabolite (
CHEBI:25212
)
(2
E
)-1,4-dimethoxybut-2-en-1-yl acetate (
CHEBI:87267
)
is a
acetate ester (
CHEBI:47622
)
(2
E
)-1,4-dimethoxybut-2-en-1-yl acetate (
CHEBI:87267
)
is a
ether (
CHEBI:25698
)
(2
E
)-1,4-dimethoxybut-2-en-1-yl acetate (
CHEBI:87267
)
is a
olefinic compound (
CHEBI:78840
)
IUPAC Name
(2
E
)-1,4-dimethoxybut-2-en-1-yl acetate
Synonym
Source
trans
-1-acetoxy-1,4-dimethoxy-2-butene
ChEBI
Registry Number
Type
Source
1937605
Reaxys Registry Number
Reaxys
Last Modified
03 September 2015