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(Q104916570)
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English
(8E,10E,12E)-14-Oxo-8,10,12-heptadecatriene-4,6-diyne-1-ol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
fatty alcohol
0 references
biogenic acyclic ketone
0 references
mass
256.14632988
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₀O₂
0 references
canonical SMILES
O=C(C=CC=CC=CC#CC#CCCCO)CCC
0 references
isomeric SMILES
CCCC(=O)/C=C/C=C/C=C/C#CC#CCCCO
1 reference
based on heuristic
inferred from InChI
found in taxon
Cicuta virosa
1 reference
stated in
Polyacetylenverbindungen, 168. Über die Polyine ausCicuta virosa L.
Identifiers
InChI
InChI=1S/C17H20O2/c1-2-14-17(19)15-12-10-8-6-4-3-5-7-9-11-13-16-18/h4,6,8,10,12,15,18H,2,11,13-14,16H2,1H3/b6-4+,10-8+,15-12+
0 references
InChIKey
APVCOKXFZCKIQG-YNQQSWPQSA-N
0 references
PubChem CID
10824982
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
APVCOKXFZCKIQG-YNQQSWPQSA-N
UniChem compound ID
625740
1 reference
stated in
UniChem
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