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ChEBI
> Main
CHEBI:76319 - docosanedioic acid
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ChEBI Name
docosanedioic acid
ChEBI ID
CHEBI:76319
Definition
An α,ω-dicarboxylic acid that is docosane in which the methyl groups have been oxidised to the corresponding carboxylic acids.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C22H42O4
Net Charge
0
Average Mass
370.56650
Monoisotopic Mass
370.30831
InChI
InChI=1S/C22H42O4/c23-
21(24)
19-
17-
15-
13-
11-
9-
7-
5-
3-
1-
2-
4-
6-
8-
10-
12-
14-
16-
18-
20-
22(25)
26/h1-
20H2,(H,23,24)
(H,25,26)
InChIKey
DGXRZJSPDXZJFG-UHFFFAOYSA-N
SMILES
OC(=O)CCCCCCCCCCCCCCCCCCCCC(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
)
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
docosanedioic acid (
CHEBI:76319
)
has parent hydride
docosane (
CHEBI:46050
)
docosanedioic acid (
CHEBI:76319
)
has role
metabolite (
CHEBI:25212
)
docosanedioic acid (
CHEBI:76319
)
is a
α,ω-dicarboxylic acid (
CHEBI:28383
)
docosanedioic acid (
CHEBI:76319
)
is a
dicarboxylic fatty acid (
CHEBI:189840
)
docosanedioic acid (
CHEBI:76319
)
is conjugate acid of
docosanedioate(2−) (
CHEBI:76299
)
Incoming
docosanedioate(2−) (
CHEBI:76299
)
is conjugate base of
docosanedioic acid (
CHEBI:76319
)
IUPAC Name
docosanedioic acid
Synonyms
Sources
1,20-Eicosanedicarboxylic acid
ChemIDplus
1,20-icosanedicarboxylic acid
ChEBI
1,22-Docosanedioic acid
ChemIDplus
Felogenic acid
ChemIDplus
Phellogenic acid
ChemIDplus
Manual Xrefs
Databases
C19625
KEGG COMPOUND
CPD-13101
MetaCyc
LMFA01170037
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1801600
Reaxys Registry Number
Reaxys
505-56-6
CAS Registry Number
ChemIDplus
Citations
Types
Sources
15716582
PubMed citation
Europe PMC
19783438
PubMed citation
Europe PMC
Last Modified
24 February 2022