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> Main
CHEBI:86582 -
O
-acetylferulic acid
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ChEBI Name
O
-acetylferulic acid
ChEBI ID
CHEBI:86582
ChEBI ASCII Name
O-acetylferulic acid
Definition
A phenyl acetate obtained by the formal condensation of the phenolic group of ferulic acid with acetic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C12H12O5
Net Charge
0
Average Mass
236.22070
Monoisotopic Mass
236.06847
InChI
InChI=1S/C12H12O5/c1-8(13)17-10-5-3-9(4-6-12(14)15)7-11(10)16-2/h3-7H,1-2H3,(H,14,15)/b6-4+
InChIKey
IHKNVZISLLDMOR-GQCTYLIASA-N
SMILES
COc1cc(\C=C\C(O)=O)ccc1OC(C)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
O
-acetylferulic acid (
CHEBI:86582
)
has functional parent
ferulic acid (
CHEBI:17620
)
O
-acetylferulic acid (
CHEBI:86582
)
is a
cinnamic acids (
CHEBI:23252
)
O
-acetylferulic acid (
CHEBI:86582
)
is a
monomethoxybenzene (
CHEBI:25235
)
O
-acetylferulic acid (
CHEBI:86582
)
is a
phenyl acetates (
CHEBI:140310
)
IUPAC Name
(2
E
)-3-[4-(acetyloxy)-3-methoxyphenyl]prop-2-enoic acid
Synonyms
Sources
3-Methoxy-4-acetoxycinnamic acid
ChemIDplus
4-Acetoxy-3-methoxycinnamic acid
ChemIDplus
acetylated ferulic acid
ChEBI
Acetylferulic acid
ChemIDplus
trans
-3-[4-acetyloxy-3-methoxyphenyl]-2-propenoic acid
ChEBI
Registry Numbers
Types
Sources
2218027
Reaxys Registry Number
Reaxys
2596-47-6
CAS Registry Number
ChemIDplus
Last Modified
03 April 2018