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ChEBI
> Main
CHEBI:30531 - pimelic acid
Main
ChEBI Ontology
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ChEBI Name
pimelic acid
ChEBI ID
CHEBI:30531
Definition
An α,ω-dicarboxylic acid that is pentane with two carboxylic acid groups at positions C-1 and C-5.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:20709, CHEBI:44980, CHEBI:24517
Supplier Information
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Read full article at Wikipedia
Formula
C7H12O4
Net Charge
0
Average Mass
160.16778
Monoisotopic Mass
160.07356
InChI
InChI=1S/C7H12O4/c8-6(9)4-2-1-3-5-7(10)11/h1-5H2,(H,8,9)(H,10,11)
InChIKey
WLJVNTCWHIRURA-UHFFFAOYSA-N
SMILES
OC(=O)CCCCCC(O)=O
Metabolite of Species
Details
Daphnia magna
(NCBI:txid35525)
See: Mixtures of similarly acting compounds in Daphnia magna: From gene to metabolite and beyondTine Vandenbrouck, Oliver A.H. Jones, Nathalie Dom, Julian L. Griffin, Wim De CoenEnvironment International 36 (2010) 254-268
Escherichia coli
(NCBI:txid562)
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):
Daphnia magna metabolite
A
Daphnia
metabolite produced by the species
Daphnia magna
.
Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in
Escherichia coli
.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
pimelic acid (
CHEBI:30531
)
has role
Daphnia magna
metabolite (
CHEBI:83056
)
pimelic acid (
CHEBI:30531
)
has role
Escherichia coli
metabolite (
CHEBI:76971
)
pimelic acid (
CHEBI:30531
)
is a
α,ω-dicarboxylic acid (
CHEBI:28383
)
pimelic acid (
CHEBI:30531
)
is a
dicarboxylic fatty acid (
CHEBI:189840
)
pimelic acid (
CHEBI:30531
)
is conjugate acid of
pimelate (
CHEBI:133773
)
pimelic acid (
CHEBI:30531
)
is conjugate acid of
pimelate(1−) (
CHEBI:17774
)
Incoming
(
S
)-2-amino-6-oxopimelic acid (
CHEBI:28245
)
has functional parent
pimelic acid (
CHEBI:30531
)
2,6-diaminopimelic acid (
CHEBI:23673
)
has functional parent
pimelic acid (
CHEBI:30531
)
2-oxopimelic acid (
CHEBI:72700
)
has functional parent
pimelic acid (
CHEBI:30531
)
3-oxopimelic acid (
CHEBI:37259
)
has functional parent
pimelic acid (
CHEBI:30531
)
4-hydroxy-2-oxoheptanedioic acid (
CHEBI:73089
)
has functional parent
pimelic acid (
CHEBI:30531
)
O
-pimelylcarnitine (
CHEBI:86084
)
has functional parent
pimelic acid (
CHEBI:30531
)
L
-2-succinylamino-6-oxoheptanedioic acid (
CHEBI:35266
)
has functional parent
pimelic acid (
CHEBI:30531
)
pimeloyl-CoA (
CHEBI:15504
)
has functional parent
pimelic acid (
CHEBI:30531
)
pimelate (
CHEBI:133773
)
is conjugate base of
pimelic acid (
CHEBI:30531
)
pimelate(1−) (
CHEBI:17774
)
is conjugate base of
pimelic acid (
CHEBI:30531
)
IUPAC Name
heptanedioic acid
Synonyms
Sources
1,5-pentanedicarboxylic acid
ChemIDplus
6-carboxyhexanoic acid
ChEBI
Heptanedioic acid
KEGG COMPOUND
Pimelate
KEGG COMPOUND
PIMELIC ACID
PDBeChem
Pimelic acid
KEGG COMPOUND
Manual Xrefs
Databases
C00001199
KNApSAcK
C02656
KEGG COMPOUND
CPD-205
MetaCyc
DB01856
DrugBank
HMDB0000857
HMDB
LMFA01170051
LIPID MAPS
Pimelic_acid
Wikipedia
PML
PDBeChem
View more database links
Registry Numbers
Types
Sources
111-16-0
CAS Registry Number
KEGG COMPOUND
111-16-0
CAS Registry Number
ChemIDplus
1210024
Reaxys Registry Number
Reaxys
1210024
Beilstein Registry Number
Beilstein
261058
Gmelin Registry Number
Gmelin
Citations
Types
Sources
20693992
PubMed citation
Europe PMC
21437340
PubMed citation
Europe PMC
22770225
PubMed citation
Europe PMC
24486440
PubMed citation
Europe PMC
Last Modified
23 February 2022