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ChEBI
> Main
CHEBI:85641 - (9
E
)-12-hydroxyoctadec-9-enoic acid
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ChEBI Name
(9
E
)-12-hydroxyoctadec-9-enoic acid
ChEBI ID
CHEBI:85641
ChEBI ASCII Name
(9E)-12-hydroxyoctadec-9-enoic acid
Definition
A hydroxy fatty acid that is (9
E
)-octadec-9-enoic (elaidic) acid carrying a hydroxy substituent at position 12.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C18H34O3
Net Charge
0
Average Mass
298.46080
Monoisotopic Mass
298.25079
InChI
InChI=1S/C18H34O3/c1-
2-
3-
4-
11-
14-
17(19)
15-
12-
9-
7-
5-
6-
8-
10-
13-
16-
18(20)
21/h9,12,17,19H,2-
8,10-
11,13-
16H2,1H3,(H,20,21)
/b12-
9+
InChIKey
WBHHMMIMDMUBKC-FMIVXFBMSA-N
SMILES
CCCCCCC(O)C\C=C\CCCCCCCC(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
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(9
E
)-12-hydroxyoctadec-9-enoic acid (
CHEBI:85641
)
has functional parent
elaidic acid (
CHEBI:27997
)
(9
E
)-12-hydroxyoctadec-9-enoic acid (
CHEBI:85641
)
is a
hydroxy fatty acid (
CHEBI:24654
)
(9
E
)-12-hydroxyoctadec-9-enoic acid (
CHEBI:85641
)
is a
hydroxy monounsaturated fatty acid (
CHEBI:131869
)
(9
E
)-12-hydroxyoctadec-9-enoic acid (
CHEBI:85641
)
is a
long-chain fatty acid (
CHEBI:15904
)
(9
E
)-12-hydroxyoctadec-9-enoic acid (
CHEBI:85641
)
is conjugate acid of
(9
E
)-12-hydroxyoctadec-9-enoate (
CHEBI:85152
)
Incoming
(9
E
)-12-hydroxyoctadec-9-enoate (
CHEBI:85152
)
is conjugate base of
(9
E
)-12-hydroxyoctadec-9-enoic acid (
CHEBI:85641
)
IUPAC Name
(9
E
)-12-hydroxyoctadec-9-enoic acid
Synonym
Source
12-hydroxyelaidic acid
ChEBI
Registry Number
Type
Source
1912866
Reaxys Registry Number
Reaxys
Last Modified
09 June 2016