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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:10046 - Wyerone acid
Main
ChEBI Ontology
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ChEBI Name
Wyerone acid
ChEBI ID
CHEBI:10046
Stars
This entity has been manually annotated by a third party.
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Formula
C14H12O4
Net Charge
0
Average Mass
244.243
Monoisotopic Mass
244.07356
InChI
InChI=1S/C14H12O4/c1-
2-
3-
4-
5-
6-
12(15)
13-
9-
7-
11(18-
13)
8-
10-
14(16)
17/h3-
4,7-
10H,2H2,1H3,(H,16,17)
/b4-
3-
,10-
8+
InChIKey
ZLZFXXJOALTVDA-JWAQTBJPSA-N
SMILES
CC\C=C/C#CC(=O)c1ccc(\C=C\C(O)=O)o1
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
Wyerone acid (
CHEBI:10046
)
is a
heterocyclic fatty acid (
CHEBI:48847
)
Synonym
Source
Wyerone acid
KEGG COMPOUND
Manual Xrefs
Databases
C00001300
KNApSAcK
C08466
KEGG COMPOUND
View more database links
Registry Number
Type
Source
54954-14-2
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014