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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:45919 - tridecanoic acid
Main
ChEBI Ontology
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ChEBI Name
tridecanoic acid
ChEBI ID
CHEBI:45919
Definition
A C
13
straight-chain saturated fatty acid.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:39247, CHEBI:45916
Supplier Information
Download
Molfile
XML
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Molfile
Molfile
Formula
C13H26O2
Net Charge
0
Average Mass
214.34430
Monoisotopic Mass
214.19328
InChI
InChI=1S/C13H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2-12H2,1H3,(H,14,15)
InChIKey
SZHOJFHSIKHZHA-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCC(O)=O
Metabolite of Species
Details
Centella asiatica
(NCBI:txid48106)
See:
MetaboLights Study
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
tridecanoic acid (
CHEBI:45919
)
has role
plant metabolite (
CHEBI:76924
)
tridecanoic acid (
CHEBI:45919
)
is a
long-chain fatty acid (
CHEBI:15904
)
tridecanoic acid (
CHEBI:45919
)
is a
straight-chain saturated fatty acid (
CHEBI:39418
)
tridecanoic acid (
CHEBI:45919
)
is conjugate acid of
tridecanoate (
CHEBI:125832
)
Incoming
(12
R
)-12-hydroxytridecanoic acid (
CHEBI:78980
)
has functional parent
tridecanoic acid (
CHEBI:45919
)
1-tridecanoyl-2-undecanoyl-
sn
-glycero-3-phosphocholine (
CHEBI:86280
)
has functional parent
tridecanoic acid (
CHEBI:45919
)
1-undecanoyl-2-tridecanoyl-
sn
-glycero-3-phosphocholine (
CHEBI:86278
)
has functional parent
tridecanoic acid (
CHEBI:45919
)
13-hydroxytridecanoic acid (
CHEBI:79166
)
has functional parent
tridecanoic acid (
CHEBI:45919
)
2-hydroxytridecanoic acid (
CHEBI:84852
)
has functional parent
tridecanoic acid (
CHEBI:45919
)
N
-tridecanoylglycine (
CHEBI:74437
)
has functional parent
tridecanoic acid (
CHEBI:45919
)
N
-tridecanoylsphingosine-1-phosphocholine (
CHEBI:85023
)
has functional parent
tridecanoic acid (
CHEBI:45919
)
tridecanoic-d
25
acid (
CHEBI:75084
)
has functional parent
tridecanoic acid (
CHEBI:45919
)
tridecanoyl-CoA (
CHEBI:85029
)
has functional parent
tridecanoic acid (
CHEBI:45919
)
tridecanoate (
CHEBI:125832
)
is conjugate base of
tridecanoic acid (
CHEBI:45919
)
IUPAC Name
tridecanoic acid
Synonyms
Sources
C13:0
ChEBI
N-TRIDECANOIC ACID
PDBeChem
n-tridecanoic acid
ChemIDplus
n-tridecoic acid
ChemIDplus
tridecylic acid
ChemIDplus
Manual Xrefs
Databases
C00007422
KNApSAcK
C17076
KEGG COMPOUND
DB02448
DrugBank
LMFA01010013
LIPID MAPS
TDA
PDBeChem
View more database links
Registry Numbers
Types
Sources
508317
Reaxys Registry Number
Reaxys
638-53-9
CAS Registry Number
NIST Chemistry WebBook
638-53-9
CAS Registry Number
ChemIDplus
Last Modified
23 October 2015