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> Main
CHEBI:84891 - ethyl (13
Z
)-docosenoate
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ChEBI Name
ethyl (13
Z
)-docosenoate
ChEBI ID
CHEBI:84891
ChEBI ASCII Name
ethyl (13Z)-docosenoate
Definition
A long-chain fatty acid ethyl ester resulting from the formal condensation of the carboxy group of (13
Z
)-docosenoic acid with the hydroxy group of ethanol.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C24H46O2
Net Charge
0
Average Mass
366.62080
Monoisotopic Mass
366.34978
InChI
InChI=1S/C24H46O2/c1-
3-
5-
6-
7-
8-
9-
10-
11-
12-
13-
14-
15-
16-
17-
18-
19-
20-
21-
22-
23-
24(25)
26-
4-
2/h11-
12H,3-
10,13-
23H2,1-
2H3/b12-
11-
InChIKey
WFZQLUSOXHIVKL-QXMHVHEDSA-N
SMILES
CCCCCCCC\C=C/CCCCCCCCCCCC(=O)OCC
ChEBI Ontology
Outgoing
ethyl (13
Z
)-docosenoate (
CHEBI:84891
)
has functional parent
erucic acid (
CHEBI:28792
)
ethyl (13
Z
)-docosenoate (
CHEBI:84891
)
is a
long-chain fatty acid ethyl ester (
CHEBI:13209
)
IUPAC Name
ethyl (13
Z
)-docos-13-enoate
Synonyms
Sources
Ethyl (Z)-docos-13-enoate
ChemIDplus
Ethyl erucate
ChemIDplus
Registry Numbers
Types
Sources
1728556
Reaxys Registry Number
Reaxys
37910-77-3
CAS Registry Number
ChemIDplus
Last Modified
18 February 2015