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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:73067 -
O
-palmitoylcarnitine
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ChEBI Ontology
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ChEBI Name
O
-palmitoylcarnitine
ChEBI ID
CHEBI:73067
ChEBI ASCII Name
O-palmitoylcarnitine
Definition
An
O
-acylcarnitine having palmitoyl (hexadecanoyl) as the acyl substituent.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C23H45NO4
Net Charge
0
Average Mass
399.60770
Monoisotopic Mass
399.33486
InChI
InChI=1S/C23H45NO4/c1-
5-
6-
7-
8-
9-
10-
11-
12-
13-
14-
15-
16-
17-
18-
23(27)
28-
21(19-
22(25)
26)
20-
24(2,3)
4/h21H,5-
20H2,1-
4H3
InChIKey
XOMRRQXKHMYMOC-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCCCC(=O)OC(CC([O-])=O)C[N+](C)(C)C
Roles Classification
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
O
-palmitoylcarnitine (
CHEBI:73067
)
has functional parent
hexadecanoic acid (
CHEBI:15756
)
O
-palmitoylcarnitine (
CHEBI:73067
)
has role
metabolite (
CHEBI:25212
)
O
-palmitoylcarnitine (
CHEBI:73067
)
is a
O
-acylcarnitine (
CHEBI:17387
)
Incoming
O
-palmitoyl-
L
-carnitine (
CHEBI:17490
)
is a
O
-palmitoylcarnitine (
CHEBI:73067
)
IUPAC Name
3-(hexadecanoyloxy)-4-(trimethylazaniumyl)butanoate
Synonyms
Sources
3-(hexadecanoyloxy)-4-(trimethylammonio)butanoate
IUPAC
hexadecanoylcarnitine
ChEBI
hexadecanoylcarnitines
ChEBI
O
-hexadecanoylcarnitine
ChEBI
palmitoylcarnitine
ChEBI
Registry Numbers
Types
Sources
1935-18-8
CAS Registry Number
ChemIDplus
4152032
Reaxys Registry Number
Reaxys
Citation
Type
Source
23315938
PubMed citation
Europe PMC
Last Modified
15 July 2015