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CHEBI:78758 - propyl dihydroferulate
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ChEBI Ontology
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ChEBI Name
propyl dihydroferulate
ChEBI ID
CHEBI:78758
Definition
A carboxylic ester that is the propyl ester of dihydroferulic acid.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C13H18O4
Net Charge
0
Average Mass
238.27960
Monoisotopic Mass
238.12051
InChI
InChI=1S/C13H18O4/c1-3-8-17-13(15)7-5-10-4-6-11(14)12(9-10)16-2/h4,6,9,14H,3,5,7-8H2,1-2H3
InChIKey
SPWKTSDNFHMAMM-UHFFFAOYSA-N
SMILES
CCCOC(=O)CCc1ccc(O)c(OC)c1
ChEBI Ontology
Outgoing
propyl dihydroferulate (
CHEBI:78758
)
has functional parent
3-phenylpropionic acid (
CHEBI:28631
)
propyl dihydroferulate (
CHEBI:78758
)
is a
aromatic ester (
CHEBI:62732
)
propyl dihydroferulate (
CHEBI:78758
)
is a
carboxylic ester (
CHEBI:33308
)
propyl dihydroferulate (
CHEBI:78758
)
is a
phenols (
CHEBI:33853
)
IUPAC Name
propyl 3-(4-hydroxy-3-methoxyphenyl)propanoate
Registry Number
Type
Source
2811999
Reaxys Registry Number
Reaxys
Last Modified
10 June 2014