(Q105007492)

English

6-[2-(2,2-dimethyl-6-methylidene-3-oxocyclohexyl)ethyl]naphthalene-1,4-dione

group of stereoisomers with the chemical formula C₂₁H₂₂O₃

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Statements

group of stereoisomers

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biogenic naphthochinone

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biogenic naphthochinone

322.1568945639999 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₂O₃

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canonical SMILES

O=C1C=CC(=O)C2=CC(=CC=C12)CCC3C(=C)CCC(=O)C3(C)C

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Identifiers

InChI=1S/C21H22O3/c1-13-4-11-20(24)21(2,3)17(13)8-6-14-5-7-15-16(12-14)19(23)10-9-18(15)22/h5,7,9-10,12,17H,1,4,6,8,11H2,2-3H3

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GFDZIJNGYPUQEC-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

GFDZIJNGYPUQEC-UHFFFAOYSA-N

UniChem compound ID

1 reference

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