(Q105129735)

English

(E)-3-(2,4-dihydroxyphenyl)-1-[(3R)-5-hydroxy-7-methoxy-2,2-dimethyl-3-(3-methylbut-2-enyl)-3,4-dihydrochromen-6-yl]prop-2-en-1-one

chemical compound

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instance of

type of chemical entity

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1 reference

3-(2,4-Dihydroxyphenyl)-1-[5-hydroxy-7-methoxy-2,2-dimethyl-3-(3-methylbut-2-enyl)-3,4-dihydrochromen-6-yl]prop-2-en-1-one

1 reference

based on heuristic

inferred from SMILES

mass

438.20423868 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(E)-3-(2,4-dihydroxyphenyl)-1-[(3S)-5-hydroxy-7-methoxy-2,2-dimethyl-3-(3-methylbut-2-enyl)-3,4-dihydrochromen-6-yl]prop-2-en-1-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₆H₃₀O₆

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canonical SMILES

O=C(C=CC1=CC=C(O)C=C1O)C=2C(O)=C3C(OC(C)(C)C(CC=C(C)C)C3)=CC2OC

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isomeric SMILES

COc1cc2c(c(O)c1C(=O)/C=C/c1ccc(O)cc1O)C[C@@H](CC=C(C)C)C(C)(C)O2

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found in taxon

Megaselia flavescens

1 reference

stated in

Phenolic constituents of the roots of Sophora flavescens

Sophora flavescens

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stated in

Phenolic constituents of the roots of Sophora flavescens

Identifiers

InChI

InChI=1S/C26H30O6/c1-15(2)6-9-17-12-19-22(32-26(17,3)4)14-23(31-5)24(25(19)30)20(28)11-8-16-7-10-18(27)13-21(16)29/h6-8,10-11,13-14,17,27,29-30H,9,12H2,1-5H3/b11-8+/t17-/m1/s1

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InChIKey

JJMWPCIGAITBBF-VGMNTSGFSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JJMWPCIGAITBBF-VGMNTSGFSA-N

(Q105129735)

(E)-3-(2,4-dihydroxyphenyl)-1-[(3R)-5-hydroxy-7-methoxy-2,2-dimethyl-3-(3-methylbut-2-enyl)-3,4-dihydrochromen-6-yl]prop-2-en-1-one

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