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(Q105280199)
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English
tremetone
group of stereoisomers with the chemical formula C₁₃H₁₄O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic benzofuran
1 reference
inferred from
biogenic benzofuran
mass
202.099379688
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₄O₂
0 references
canonical SMILES
O=C(C1=CC=C2OC(C(=C)C)CC2=C1)C
0 references
found in taxon
Liatris
1 reference
stated in
EIn neues euparin-derivat aus Liatris squarrosa
Praxelis diffusa
1 reference
stated in
Neue sesquiterpenlactone und andere inhaltsstoffe aus vertretern der Eupatorium-gruppe
Praxelis pauciflora
1 reference
stated in
Neue sesquiterpenlactone und andere inhaltsstoffe aus vertretern der Eupatorium-gruppe
Ageratina altissima var. altissima
1 reference
stated in
Neue sesquiterpenlactone und andere inhaltsstoffe aus vertretern der Eupatorium-gruppe
Identifiers
InChI
InChI=1S/C13H14O2/c1-8(2)13-7-11-6-10(9(3)14)4-5-12(11)15-13/h4-6,13H,1,7H2,2-3H3
0 references
InChIKey
UVYUUQGGBNKRFU-UHFFFAOYSA-N
0 references
PubChem CID
317196
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UVYUUQGGBNKRFU-UHFFFAOYSA-N
UniChem compound ID
23284064
1 reference
stated in
UniChem
NMRShiftDB structure ID
20132941
1 reference
matched by identifier from
InChIKey
InChIKey
UVYUUQGGBNKRFU-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0259119
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UVYUUQGGBNKRFU-UHFFFAOYSA-N
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