(Q105246506)

English

6-(2-hydroperoxy-1,3-dihydroxy-3-methylbutyl)-7-hydroxychromen-2-one

group of stereoisomers with the chemical formula C₁₄H₁₆O₇

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Statements

group of stereoisomers

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biogenic coumarin

1 reference

biogenic coumarin

296.089602852 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₄H₁₆O₇

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canonical SMILES

O=C1OC=2C=C(O)C(=CC2C=C1)C(O)C(OO)C(O)(C)C

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Identifiers

InChI=1S/C14H16O7/c1-14(2,18)13(21-19)12(17)8-5-7-3-4-11(16)20-10(7)6-9(8)15/h3-6,12-13,15,17-19H,1-2H3

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RWHIGPWYYDEVKU-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

RWHIGPWYYDEVKU-UHFFFAOYSA-N

UniChem compound ID

1 reference

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