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(Q105096090)
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English
[(7E,9E,16Z)-18-hydroxyoctadeca-7,9,16-trien-11,13-diyn-4-yl] acetate
group of stereoisomers with the chemical formula C₂₀H₂₆O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic acyclic ester
1 reference
inferred from
biogenic acyclic ester
fatty alcohol
1 reference
inferred from
fatty alcohol
mass
314.188194692
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₆O₃
0 references
canonical SMILES
O=C(OC(CCC=CC=CC#CC#CCC=CCO)CCC)C
0 references
isomeric SMILES
CCCC(CC/C=C/C=C/C#CC#CC/C=C\CO)OC(C)=O
0 references
found in taxon
Bupleurum longiradiatum
1 reference
stated in
Polyacetylenes from Bupleurum longiradiatum
Identifiers
InChI
InChI=1S/C20H26O3/c1-3-16-20(23-19(2)22)17-14-12-10-8-6-4-5-7-9-11-13-15-18-21/h6,8,10,12-13,15,20-21H,3,11,14,16-18H2,1-2H3/b8-6+,12-10+,15-13-
0 references
InChIKey
AKVJQLCJYKTDNL-UHXCPQQUSA-N
0 references
PubChem CID
5315585
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AKVJQLCJYKTDNL-UHXCPQQUSA-N
UniChem compound ID
67810742
1 reference
stated in
UniChem
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