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> Main
CHEBI:41865 - sebacic acid
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ChEBI Name
sebacic acid
ChEBI ID
CHEBI:41865
Definition
An α,ω-dicarboxylic acid that is the 1,8-dicarboxy derivative of octane.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:41860, CHEBI:9071
Supplier Information
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Read full article at Wikipedia
Formula
C10H18O4
Net Charge
0
Average Mass
202.24752
Monoisotopic Mass
202.12051
InChI
InChI=1S/C10H18O4/c11-9(12)7-5-3-1-2-4-6-8-10(13)14/h1-8H2,(H,11,12)(H,13,14)
InChIKey
CXMXRPHRNRROMY-UHFFFAOYSA-N
SMILES
OC(=O)CCCCCCCCC(O)=O
Metabolite of Species
Details
Caesalpinia pulcherrima
(NCBI:txid53846)
Found in stem
(BTO:0001300)
. See:
DOI
Homo sapiens
(NCBI:txid9606)
See:
PubMed
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):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
sebacic acid (
CHEBI:41865
)
has parent hydride
decane (
CHEBI:41808
)
sebacic acid (
CHEBI:41865
)
has role
human metabolite (
CHEBI:77746
)
sebacic acid (
CHEBI:41865
)
has role
plant metabolite (
CHEBI:76924
)
sebacic acid (
CHEBI:41865
)
is a
α,ω-dicarboxylic acid (
CHEBI:28383
)
sebacic acid (
CHEBI:41865
)
is a
dicarboxylic fatty acid (
CHEBI:189840
)
sebacic acid (
CHEBI:41865
)
is conjugate acid of
sebacate (
CHEBI:132954
)
sebacic acid (
CHEBI:41865
)
is conjugate acid of
sebacate(2−) (
CHEBI:76283
)
Incoming
3-hydroxysebacic acid (
CHEBI:89182
)
has functional parent
sebacic acid (
CHEBI:41865
)
decanedioyl-CoA (
CHEBI:76345
)
has functional parent
sebacic acid (
CHEBI:41865
)
dimethyl sebacate (
CHEBI:194205
)
has functional parent
sebacic acid (
CHEBI:41865
)
sebacate (
CHEBI:132954
)
is conjugate base of
sebacic acid (
CHEBI:41865
)
sebacate(2−) (
CHEBI:76283
)
is conjugate base of
sebacic acid (
CHEBI:41865
)
IUPAC Name
decanedioic acid
Synonyms
Sources
1,10-decanedioic acid
NIST Chemistry WebBook
1,8-dicarboxyoctane
ChEBI
Decanedioic acid
KEGG COMPOUND
Sebacic acid
KEGG COMPOUND
SEBACIC ACID
PDBeChem
Sebacinsäure
ChEBI
Manual Xrefs
Databases
C00001202
KNApSAcK
C08277
KEGG COMPOUND
CPD-3623
MetaCyc
DB07645
DrugBank
DEC
PDBeChem
HMDB0000792
HMDB
LMFA01170006
LIPID MAPS
Sebacic_acid
Wikipedia
View more database links
Registry Numbers
Types
Sources
102423
Gmelin Registry Number
Gmelin
111-20-6
CAS Registry Number
NIST Chemistry WebBook
111-20-6
CAS Registry Number
ChemIDplus
1210591
Beilstein Registry Number
ChemIDplus
1210591
Reaxys Registry Number
Reaxys
Citations
Types
Sources
22770225
PubMed citation
Europe PMC
9439441
PubMed citation
Europe PMC
Last Modified
10 January 2023