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> Main
CHEBI:30907 - 4-fumarylacetoacetic acid
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ChEBI Name
4-fumarylacetoacetic acid
ChEBI ID
CHEBI:30907
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:20369, CHEBI:1830
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Formula
C8H8O6
Net Charge
0
Average Mass
200.14552
Monoisotopic Mass
200.03209
InChI
InChI=1S/C8H8O6/c9-5(1-2-7(11)12)3-6(10)4-8(13)14/h1-2H,3-4H2,(H,11,12)(H,13,14)/b2-1+
InChIKey
GACSIVHAIFQKTC-OWOJBTEDSA-N
SMILES
OC(=O)CC(=O)CC(=O)\C=C\C(O)=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
4-fumarylacetoacetic acid (
CHEBI:30907
)
has functional parent
oct-2-enedioic acid (
CHEBI:36279
)
4-fumarylacetoacetic acid (
CHEBI:30907
)
is a
β-diketone (
CHEBI:67265
)
4-fumarylacetoacetic acid (
CHEBI:30907
)
is a
dicarboxylic fatty acid (
CHEBI:189840
)
4-fumarylacetoacetic acid (
CHEBI:30907
)
is a
oxo dicarboxylic acid (
CHEBI:36145
)
4-fumarylacetoacetic acid (
CHEBI:30907
)
is conjugate acid of
4-fumarylacetoacetate(2−) (
CHEBI:18034
)
Incoming
4-fumarylacetoacetate(2−) (
CHEBI:18034
)
is conjugate base of
4-fumarylacetoacetic acid (
CHEBI:30907
)
IUPAC Name
(2
E
)-4,6-dioxooct-2-enedioic acid
Synonyms
Sources
4-Fumarylacetoacetic acid
KEGG COMPOUND
Fumarylacetoacetone
ChemIDplus
Manual Xrefs
Databases
C00007599
KNApSAcK
C01061
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
1726101
Beilstein Registry Number
Beilstein
28613-33-4
CAS Registry Number
KEGG COMPOUND
28613-33-4
CAS Registry Number
ChemIDplus
Last Modified
24 February 2022