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CHEBI:76282 - suberate(2−)
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ChEBI Ontology
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ChEBI Name
suberate(2−)
ChEBI ID
CHEBI:76282
ChEBI ASCII Name
suberate(2-)
Definition
A dicarboxylic acid dianion obtained by deprotonation of both carboxy groups of suberic acid; major species at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Lucila Aimo
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Formula
C8H12O4
Net Charge
-2
Average Mass
172.17850
Monoisotopic Mass
172.07466
InChI
InChI=1S/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12)/p-2
InChIKey
TYFQFVWCELRYAO-UHFFFAOYSA-L
SMILES
[O-]C(=O)CCCCCCC([O-])=O
ChEBI Ontology
Outgoing
suberate(2−) (
CHEBI:76282
)
is a
saturated dicarboxylic acid dianion(2−) (
CHEBI:133291
)
suberate(2−) (
CHEBI:76282
)
is a
suberate (
CHEBI:132953
)
suberate(2−) (
CHEBI:76282
)
is conjugate base of
suberic acid (
CHEBI:9300
)
Incoming
suberic acid (
CHEBI:9300
)
is conjugate acid of
suberate(2−) (
CHEBI:76282
)
IUPAC Name
octanedioate
Synonyms
Sources
C
8
-DCA(2−)
SUBMITTER
octanedioate
UniProt
octanedioate(2−)
ChEBI
suberate
ChEBI
Manual Xref
Database
CPD0-1264
MetaCyc
View more database links
Registry Number
Type
Source
3905392
Reaxys Registry Number
Reaxys
Last Modified
16 September 2021