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(Q105158378)
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English
methyl 3-(2,3-dimethyl-2-{[(2-oxochromen-7-yl)oxy]methyl}-6-(propan-2-ylidene)cyclohexyl)propanoate
group of stereoisomers with the chemical formula C₂₅H₃₂O₅
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Statements
instance of
group of stereoisomers
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subclass of
biogenic coumarin
1 reference
inferred from
biogenic coumarin
mass
412.22497412399986
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₃₂O₅
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canonical SMILES
O=C1OC=2C=C(OCC3(C)C(C(=C(C)C)CCC3C)CCC(=O)OC)C=CC2C=C1
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Identifiers
InChI
InChI=1S/C25H32O5/c1-16(2)20-10-6-17(3)25(4,21(20)11-13-23(26)28-5)15-29-19-9-7-18-8-12-24(27)30-22(18)14-19/h7-9,12,14,17,21H,6,10-11,13,15H2,1-5H3
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InChIKey
LWKZASDDSMSRFV-UHFFFAOYSA-N
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PubChem CID
3803314
1 reference
based on heuristic
inferred from InChIKey
UniChem compound ID
43217615
1 reference
stated in
UniChem
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