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(Q105208388)
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English
[(3S,4E,6E,12E)-3-acetyloxytetradeca-4,6,12-trien-8,10-diynyl] acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(4E,6E,12E)-Tetradecatriene-8,10-diyne-1,3-diol diacetate
1 reference
based on heuristic
inferred from SMILES
mass
300.13615912
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₀O₄
0 references
canonical SMILES
O=C(OCCC(OC(=O)C)C=CC=CC#CC#CC=CC)C
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isomeric SMILES
C/C=C/C#CC#C/C=C/C=C/[C@H](CCOC(C)=O)OC(C)=O
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found in taxon
Atractylodes lancea
1 reference
stated in
Further phenols and polyacetylenes from the rhizomes of Atractylodes lancea and their anti-inflammatory activity
Carthamus tinctorius
1 reference
stated in
Polyacetylenverbindungen, CXIV. Die Polyine der GattungCarthamus L.
Centaurea diluta
1 reference
stated in
Polyacetylenverbindungen, CXVII. Neue Polyine der GattungCentaurea L.
Centaurea macrocephala
1 reference
stated in
Polyacetylenverbindungen, 117. Über die Inhaltsstoffe ausCentaurea macrocephala Puschk.
Centaurea montana
1 reference
stated in
Acetylenes and other constituents from Centaurea species
Dahlia australis
1 reference
stated in
Polyacetylenes from Dahlia species
Dahlia sherffii
1 reference
stated in
Polyacetylenes from Dahlia species
Pleiotaxis rugosa
1 reference
stated in
Chemotaxonomy of the genus pleiotaxis*
Identifiers
InChI
InChI=1S/C18H20O4/c1-4-5-6-7-8-9-10-11-12-13-18(22-17(3)20)14-15-21-16(2)19/h4-5,10-13,18H,14-15H2,1-3H3/b5-4+,11-10+,13-12+/t18-/m1/s1
0 references
InChIKey
PGHCYQUSYHWJAI-GWNNJWKOSA-N
0 references
PubChem CID
92974046
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PGHCYQUSYHWJAI-GWNNJWKOSA-N
UniChem compound ID
104509369
1 reference
stated in
UniChem
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