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(Q105199244)
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English
1,3-dimethyl-2-[(1E,3E)-3-methylocta-1,3-dienyl]-4-oxocyclohex-2-ene-1-carboxylic acid
group of stereoisomers with the chemical formula C₁₈H₂₆O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
290.188194692
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₆O₃
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canonical SMILES
O=C(O)C1(C(C=CC(=CCCCC)C)=C(C(=O)CC1)C)C
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isomeric SMILES
CCCC/C=C(C)/C=C/C1=C(C)C(=O)CCC1(C)C(=O)O
1 reference
based on heuristic
inferred from InChI
found in taxon
Phycomyces blakesleeanus
1 reference
stated in
Acidic metabolites from Phycomyces blakesleeanus
Identifiers
InChI
InChI=1S/C18H26O3/c1-5-6-7-8-13(2)9-10-15-14(3)16(19)11-12-18(15,4)17(20)21/h8-10H,5-7,11-12H2,1-4H3,(H,20,21)/b10-9+,13-8+
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InChIKey
OSQWPUQNCKZCOA-URERACSSSA-N
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PubChem CID
6450220
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
32028495
1 reference
stated in
UniChem
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