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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:137704 - (9
R
,13
R
)-1a,1b-dihomo-jasmonic acid
Main
ChEBI Ontology
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ChEBI Name
(9
R
,13
R
)-1a,1b-dihomo-jasmonic acid
ChEBI ID
CHEBI:137704
ChEBI ASCII Name
(9R,13R)-1a,1b-dihomo-jasmonic acid
Stars
This entity has been manually annotated by a third party.
Supplier Information
ChemicalBook:CB5855401
,
ZINC000005854633
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Formula
C14H22O3
Net Charge
0
Average Mass
238.323
Monoisotopic Mass
238.15689
InChI
InChI=1S/C14H22O3/c1-
2-
3-
4-
7-
12-
11(9-
10-
13(12)
15)
6-
5-
8-
14(16)
17/h3-
4,11-
12H,2,5-
10H2,1H3,(H,16,17)
/b4-
3-
/t11-
,12-
/m1/s1
InChIKey
LVQJNKFFJNUFNY-OPVGQWETSA-N
SMILES
C(O)(=O)CCC[C@@H]1CCC([C@@H]1C/C=C\CC)=O
ChEBI Ontology
Outgoing
(9
R
,13
R
)-1a,1b-dihomo-jasmonic acid (
CHEBI:137704
)
is a
cyclic ketone (
CHEBI:3992
)
Manual Xref
Database
LMFA02010010
LIPID MAPS
View more database links
Last Modified
10 July 2017