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(Q105221263)
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English
[(3S,4E,6E)-1-acetyloxytetradeca-4,6-dien-8,10,12-triyn-3-yl] (Z)-2-methylbut-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
mass
338.151809184
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(3S)-1-acetyloxytetradeca-4,6-dien-8,10,12-triyn-3-yl] 2-methylbut-2-enoate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₂O₄
0 references
canonical SMILES
O=C(OC(C=CC=CC#CC#CC#CC)CCOC(=O)C)C(=CC)C
0 references
isomeric SMILES
CC#CC#CC#C/C=C/C=C/[C@H](CCOC(C)=O)OC(=O)/C(C)=C\C
0 references
found in taxon
Filago congesta
1 reference
stated in
New constituents of Leontopodium alpinum and their in vitro leukotriene biosynthesis inhibitory activity
Leontopodium alpinum
1 reference
stated in
New constituents of Leontopodium alpinum and their in vitro leukotriene biosynthesis inhibitory activity
Identifiers
InChI
InChI=1S/C21H22O4/c1-5-7-8-9-10-11-12-13-14-15-20(16-17-24-19(4)22)25-21(23)18(3)6-2/h6,12-15,20H,16-17H2,1-4H3/b13-12+,15-14+,18-6-/t20-/m1/s1
0 references
InChIKey
QHZNYIUZHDAGDF-LCGCMJHXSA-N
0 references
PubChem CID
163195503
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QHZNYIUZHDAGDF-LCGCMJHXSA-N
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