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> Main
CHEBI:73071 -
O
-(13-carboxytridecanoyl)carnitine
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ChEBI Name
O
-(13-carboxytridecanoyl)carnitine
ChEBI ID
CHEBI:73071
ChEBI ASCII Name
O-(13-carboxytridecanoyl)carnitine
Definition
An
O
-acylcarnitine having 13-carboxytridecanoyl as the acyl substituent.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C21H39NO6
Net Charge
0
Average Mass
401.53750
Monoisotopic Mass
401.27774
InChI
InChI=1S/C21H39NO6/c1-
22(2,3)
17-
18(16-
20(25)
26)
28-
21(27)
15-
13-
11-
9-
7-
5-
4-
6-
8-
10-
12-
14-
19(23)
24/h18H,4-
17H2,1-
3H3,(H-
,23,24,25,26)
InChIKey
AHBCTRVDGQMKHC-UHFFFAOYSA-N
SMILES
C[N+](C)(C)CC(CC([O-])=O)OC(=O)CCCCCCCCCCCCC(O)=O
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
-(13-carboxytridecanoyl)carnitine (
CHEBI:73071
)
has functional parent
carnitine (
CHEBI:17126
)
O
-(13-carboxytridecanoyl)carnitine (
CHEBI:73071
)
has role
metabolite (
CHEBI:25212
)
O
-(13-carboxytridecanoyl)carnitine (
CHEBI:73071
)
is a
O
-acylcarnitine (
CHEBI:17387
)
O
-(13-carboxytridecanoyl)carnitine (
CHEBI:73071
)
is a
ammonium betaine (
CHEBI:35284
)
O
-(13-carboxytridecanoyl)carnitine (
CHEBI:73071
)
is a
carboxylic ester (
CHEBI:33308
)
IUPAC Name
3-[(13-carboxytridecanoyl)oxy]-4-(trimethylazaniumyl)butanoate
Synonyms
Sources
13-carboxytridecanoylcarnitine
ChEBI
3-[(13-carboxytridecanoyl)oxy]-4-(trimethylammonio)butanoate
IUPAC
Citation
Type
Source
23315938
PubMed citation
Europe PMC
Last Modified
14 May 2013