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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:32375 - petroselinate
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ChEBI Ontology
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ChEBI Name
petroselinate
ChEBI ID
CHEBI:32375
Definition
An unsaturated fatty acid anion resulting from the deprotonation of the carboxy group of petroselinic acid. The major species at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
Formula
C18H33O2
Net Charge
-1
Average Mass
281.454
Monoisotopic Mass
281.24860
InChI
InChI=1S/C18H34O2/c1-
2-
3-
4-
5-
6-
7-
8-
9-
10-
11-
12-
13-
14-
15-
16-
17-
18(19)
20/h12-
13H,2-
11,14-
17H2,1H3,(H,19,20)
/p-
1/b13-
12-
InChIKey
CNVZJPUDSLNTQU-SEYXRHQNSA-M
SMILES
C(C/C=C\CCCCCCCCCCC)CCC(=O)[O-]
ChEBI Ontology
Outgoing
petroselinate (
CHEBI:32375
)
is a
long-chain fatty acid anion (
CHEBI:57560
)
petroselinate (
CHEBI:32375
)
is a
octadecenoate (
CHEBI:78049
)
petroselinate (
CHEBI:32375
)
is a
unsaturated fatty acid anion (
CHEBI:2580
)
petroselinate (
CHEBI:32375
)
is conjugate base of
petroselinic acid (
CHEBI:28194
)
Incoming
petroselinic acid (
CHEBI:28194
)
is conjugate acid of
petroselinate (
CHEBI:32375
)
IUPAC Name
(6
Z
)-octadec-6-enoate
Synonyms
Sources
(6
Z
)-octadecenoate
UniProt
(6
Z
)-petroselinate
ChEBI
(
Z
)-6-octadecenoate
ChEBI
cis
-Δ
6
-octadecenoate
ChEBI
cis
-octadec-6-enoate
ChEBI
cis
-ω-12-octadecenoate
ChEBI
cis
-petroselinate
ChEBI
Last Modified
10 November 2015