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(Q105227918)
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English
butyl (2E)-3-{4-hydroxy-3-[(2-methylpropanoyl)oxy]phenyl}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
306.146723804
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₂O₅
0 references
canonical SMILES
O=C(OCCCC)C=CC1=CC=C(O)C(OC(=O)C(C)C)=C1
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isomeric SMILES
CCCCOC(=O)/C=C/c1ccc(O)c(OC(=O)C(C)C)c1
1 reference
based on heuristic
inferred from InChI
found in taxon
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/C17H22O5/c1-4-5-10-21-16(19)9-7-13-6-8-14(18)15(11-13)22-17(20)12(2)3/h6-9,11-12,18H,4-5,10H2,1-3H3/b9-7+
0 references
InChIKey
QTTNNIJQZLLSTH-VQHVLOKHSA-N
0 references
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