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(Q105269507)
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English
icosyl (Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkyl caffeate ester
0 references
mass
474.37091008
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₅₀O₄
0 references
canonical SMILES
O=C(OCCCCCCCCCCCCCCCCCCCC)C=CC1=CC=C(O)C(OC)=C1
0 references
isomeric SMILES
CCCCCCCCCCCCCCCCCCCCOC(=O)/C=C\c1ccc(O)c(OC)c1
1 reference
based on heuristic
inferred from InChI
found in taxon
Pavetta owariensis
1 reference
stated in
Ferulic acid esters from stem bark of Pavetta owariensis
Identifiers
InChI
InChI=1S/C30H50O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-34-30(32)24-22-27-21-23-28(31)29(26-27)33-2/h21-24,26,31H,3-20,25H2,1-2H3/b24-22-
0 references
InChIKey
UBNJQWYYWIBSGN-GYHWCHFESA-N
0 references
PubChem CID
5317019
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UBNJQWYYWIBSGN-GYHWCHFESA-N
UniChem compound ID
45336230
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0302971
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UBNJQWYYWIBSGN-GYHWCHFESA-N
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