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ChEBI
> Main
CHEBI:63216 - 5(
S
),8(
R
)-DiHODE
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ChEBI Ontology
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ChEBI Name
5(
S
),8(
R
)-DiHODE
ChEBI ID
CHEBI:63216
ChEBI ASCII Name
5(S),8(R)-DiHODE
Definition
A dihydroxy monocarboxylic acid that is the (5
S
,8
R
)-dihydroxy derivative of linoleic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
Formula
C18H32O4
Net Charge
0
Average Mass
312.44430
Monoisotopic Mass
312.23006
InChI
InChI=1S/C18H32O4/c1-
2-
3-
4-
5-
6-
7-
8-
9-
11-
16(19)
14-
15-
17(20)
12-
10-
13-
18(21)
22/h6-
7,9,11,16-
17,19-
20H,2-
5,8,10,12-
15H2,1H3,(H,21,22)
/b7-
6-
,11-
9-
/t16-
,17-
/m0/s1
InChIKey
CVXOCQUHJDKXHR-JFKQHRMJSA-N
SMILES
CCCCC\C=C/C\C=C/[C@H](O)CC[C@@H](O)CCCC(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
5(
S
),8(
R
)-DiHODE (
CHEBI:63216
)
has functional parent
linoleic acid (
CHEBI:17351
)
5(
S
),8(
R
)-DiHODE (
CHEBI:63216
)
is a
dihydroxy monocarboxylic acid (
CHEBI:35972
)
5(
S
),8(
R
)-DiHODE (
CHEBI:63216
)
is a
octadecanoid (
CHEBI:36326
)
5(
S
),8(
R
)-DiHODE (
CHEBI:63216
)
is conjugate acid of
5(
S
),8(
R
)-DiHODE(1−) (
CHEBI:63217
)
Incoming
5(
S
),8(
R
)-DiHODE(1−) (
CHEBI:63217
)
is conjugate base of
5(
S
),8(
R
)-DiHODE (
CHEBI:63216
)
IUPAC Name
(5
S
,8
R
,9
Z
,12
Z
)-5,8-dihydroxyoctadeca-9,12-dienoic acid
Synonym
Source
(5
S
,8
R
)-5,8-dihydroxylinoleic acid
ChEBI
Citations
Types
Sources
19286665
PubMed citation
Europe PMC
20045744
PubMed citation
Europe PMC
21130068
PubMed citation
Europe PMC
Last Modified
18 November 2011