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(Q105312192)
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English
6-methoxy-7-{[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]oxy}chromen-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic coumarin
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farnesane sesquiterpenoid
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mass
396.230059504
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₃₂O₄
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canonical SMILES
O=C1OC=2C=C(OCC=C(C)CCC=C(C)CCC=C(C)C)C(OC)=CC2C=C1
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isomeric SMILES
COc1cc2ccc(=O)oc2cc1OC/C=C(\C)CC/C=C(\C)CCC=C(C)C
1 reference
based on heuristic
inferred from InChI
found in taxon
Brocchia cinerea
1 reference
stated in
Sesquiterpene-coumarin ethers and polyacetylenes from Bfrocchia cinerea
Artemisia persica
1 reference
stated in
Scopoletin sesquiterpene ethers from Artemisia persica
Identifiers
InChI
InChI=1S/C25H32O4/c1-18(2)8-6-9-19(3)10-7-11-20(4)14-15-28-24-17-22-21(16-23(24)27-5)12-13-25(26)29-22/h8,10,12-14,16-17H,6-7,9,11,15H2,1-5H3/b19-10+,20-14+
0 references
InChIKey
WSXGDXUBCDOPHO-GNUCVDFRSA-N
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