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(Q105329754)
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English
[(E)-3-methylsulfonylprop-2-enyl] (E)-3-phenylprop-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Methylsulfonylallylcinnamat
1 reference
based on heuristic
inferred from InChIKey
mass
266.061279928
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₄O₄S
0 references
canonical SMILES
O=C(OCC=CS(=O)(=O)C)C=CC=1C=CC=CC1
0 references
isomeric SMILES
CS(=O)(=O)/C=C/COC(=O)/C=C/c1ccccc1
1 reference
based on heuristic
inferred from InChI
found in taxon
Aiouea montana
1 reference
stated in
Derivado cinamoílico com atividade no reparo de DNA e outras substâncias de Cinnamomum australe (Lauraceae)
Identifiers
InChI
InChI=1S/C13H14O4S/c1-18(15,16)11-5-10-17-13(14)9-8-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3/b9-8+,11-5+
0 references
InChIKey
XKWYWPLJJOFUCZ-SXGHKVHISA-N
0 references
PubChem CID
5384885
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XKWYWPLJJOFUCZ-SXGHKVHISA-N
UniChem compound ID
52667631
1 reference
stated in
UniChem
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