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(Q82248058)
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English
Butyl 3-(3,4-dihydroxyphenyl)acrylate
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
alkyl caffeate ester
0 references
mass
236.104858992
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₆O₄
0 references
canonical SMILES
O=C(OCCCC)C=CC1=CC=C(O)C(O)=C1
0 references
isomeric SMILES
CCCCOC(=O)/C=C/C1=CC(=C(C=C1)O)O
0 references
found in taxon
basil
1 reference
stated in
The Constituents of the Leaves of Ocimum basilicum
Populus laurifolia
1 reference
stated in
Analysis of phenolics of bud exudate of Populus angustifolia by GC-MS
Smilax bockii
1 reference
stated in
Antiinflammatory constituents from the roots of Smilax bockii warb
Traversia baccharoides
1 reference
stated in
A new truxillate and some flavonoid esters from the leaf gum of Traversiabaccharoides Hook. f.
Identifiers
InChI
InChI=1S/C13H16O4/c1-2-3-8-17-13(16)7-5-10-4-6-11(14)12(15)9-10/h4-7,9,14-15H,2-3,8H2,1H3/b7-5+
0 references
InChIKey
DBBCBZIFZYILRL-FNORWQNLSA-N
0 references
CAS Registry Number
22020-28-6
0 references
PubChem CID
9991705
1 reference
matched by identifier from
InChIKey
InChIKey
DBBCBZIFZYILRL-FNORWQNLSA-N
UniChem compound ID
575470
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20433816
1 reference
matched by identifier from
InChIKey
InChIKey
DBBCBZIFZYILRL-FNORWQNLSA-N
DSSTOX compound identifier
DTXCID90384644
0 references
KNApSAcK ID
C00060825
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DBBCBZIFZYILRL-FNORWQNLSA-N
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