(Q105328689)

English

4-{[(2E)-4-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]oxy}-5-methylchromen-2-one

group of stereoisomers with the chemical formula C₂₀H₂₄O₄

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Statements

group of stereoisomers

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2,6-dimethyloctane monoterpenoid

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2,6-dimethyloctane monoterpenoid

biogenic coumarin

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biogenic coumarin

328.167459248 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₄O₄

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canonical SMILES

O=C1OC2=CC=CC(=C2C(OCC=C(C)C(O)CC=C(C)C)=C1)C

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isomeric SMILES

CC(C)=CCC(O)/C(C)=C/COc1cc(=O)oc2cccc(C)c12

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C20H24O4/c1-13(2)8-9-16(21)14(3)10-11-23-18-12-19(22)24-17-7-5-6-15(4)20(17)18/h5-8,10,12,16,21H,9,11H2,1-4H3/b14-10+

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XIQXQZGEDPETFJ-GXDHUFHOSA-N

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