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(Q105178568)
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English
(E)-3-Methoxy-4-hydroxybenzeneacrylic acid henicosyl ester
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkyl caffeate ester
0 references
mass
488.386560144
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₁H₅₂O₄
0 references
canonical SMILES
O=C(OCCCCCCCCCCCCCCCCCCCCC)C=CC1=CC=C(O)C(OC)=C1
0 references
isomeric SMILES
CCCCCCCCCCCCCCCCCCCCCOC(=O)/C=C/c1ccc(O)c(OC)c1
1 reference
based on heuristic
inferred from InChI
found in taxon
Juniperus formosana
2 references
stated in
Dehydroabietane diterpenes from Juniperus formosana hay. var. concolor hay
stated in
Dehydroabietane diterpenes from Juniperus formosana hay. var. concolor hay
Pavetta owariensis
1 reference
stated in
Ferulic acid esters from stem bark of Pavetta owariensis
Identifiers
InChI
InChI=1S/C31H52O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-35-31(33)25-23-28-22-24-29(32)30(27-28)34-2/h22-25,27,32H,3-21,26H2,1-2H3/b25-23+
0 references
InChIKey
NFNFRLNNJQMLCH-WJTDDFOZSA-N
0 references
PubChem CID
101634607
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NFNFRLNNJQMLCH-WJTDDFOZSA-N
UniChem compound ID
97201637
1 reference
stated in
UniChem
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