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> Main
CHEBI:31001 - octacosanoic acid
Main
ChEBI Ontology
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ChEBI Name
octacosanoic acid
ChEBI ID
CHEBI:31001
Definition
A straight-chain saturated fatty acid that is octacosane in which one of the terminal methyl groups has been oxidised to the corresponding carboxy group.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
qingping liu
Secondary ChEBI IDs
CHEBI:132862
Supplier Information
Download
Molfile
XML
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Molfile
Wikipedia
License
Read full article at Wikipedia
Formula
C28H56O2
Net Charge
0
Average Mass
424.744
Monoisotopic Mass
424.42803
InChI
InChI=1S/C28H56O2/c1-
2-
3-
4-
5-
6-
7-
8-
9-
10-
11-
12-
13-
14-
15-
16-
17-
18-
19-
20-
21-
22-
23-
24-
25-
26-
27-
28(29)
30/h2-
27H2,1H3,(H,29,30)
InChIKey
UTOPWMOLSKOLTQ-UHFFFAOYSA-N
SMILES
C(CCCCCCCCCCCCCCCC)CCCCCCCCCCC(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):
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
octacosanoic acid (
CHEBI:31001
)
has role
plant metabolite (
CHEBI:76924
)
octacosanoic acid (
CHEBI:31001
)
is a
straight-chain saturated fatty acid (
CHEBI:39418
)
octacosanoic acid (
CHEBI:31001
)
is a
ultra-long-chain fatty acid (
CHEBI:143004
)
octacosanoic acid (
CHEBI:31001
)
is conjugate acid of
octacosanoate (
CHEBI:31002
)
Incoming
ω-hydroxyoctacosanoic acid (
CHEBI:84863
)
has functional parent
octacosanoic acid (
CHEBI:31001
)
(
R
)-3-hydroxyoctacosanoyl-CoA (
CHEBI:76472
)
has functional parent
octacosanoic acid (
CHEBI:31001
)
2-hydroxyoctacosanoic acid (
CHEBI:85340
)
has functional parent
octacosanoic acid (
CHEBI:31001
)
26-methyloctacosanoic acid (
CHEBI:84885
)
has functional parent
octacosanoic acid (
CHEBI:31001
)
N
-octacosanoylsphingosine (
CHEBI:83364
)
has functional parent
octacosanoic acid (
CHEBI:31001
)
lysophosphatidylcholine 28:0 (
CHEBI:85561
)
has functional parent
octacosanoic acid (
CHEBI:31001
)
octacosanoyl-CoA (
CHEBI:74150
)
has functional parent
octacosanoic acid (
CHEBI:31001
)
octacosanoate (
CHEBI:31002
)
is conjugate base of
octacosanoic acid (
CHEBI:31001
)
IUPAC Name
octacosanoic acid
Synonyms
Sources
1-octacosanoic acid
ChEBI
CH
3
‒[CH
2
]
26
‒COOH
IUPAC
montanic acid
NIST Chemistry WebBook
n
-octacosanoic acid
ChEBI
n
-octaeicosanoic acid
ChEBI
Octacosancarbonsäure
ChEBI
Octacosansäure
ChEBI
octacosoic acid
ChEBI
octaeicosanoic acid
ChEBI
Manual Xrefs
Databases
HMDB0002348
HMDB
LMFA01010028
LIPID MAPS
Montanic_acid
Wikipedia
View more database links
Registry Numbers
Types
Sources
1801616
Reaxys Registry Number
Reaxys
506-48-9
CAS Registry Number
ChemIDplus
506-48-9
CAS Registry Number
NIST Chemistry WebBook
Citations
Types
Sources
15376388
PubMed citation
Europe PMC
15847942
PubMed citation
Europe PMC
24218964
PubMed citation
Europe PMC
2474624
PubMed citation
Europe PMC
Last Modified
30 January 2019
General Comments
2011-01-15
Found in human brain and visceral organs.
2011-01-15
Formed from octacosanol via beta-oxidation.