(Q104975023)

English

(2S)-2-[(2R,3R)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-5-yl]-5,7-dihydroxy-8-[(2R)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]-2,3-dihydrochromen-4-one

chemical compound

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instance of

type of chemical entity

0 references

1 reference

1 reference

650.251582796 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S)-2-[(2R,3R)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-5-yl]-5,7-dihydroxy-8-[(2S)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]-2,3-dihydrochromen-4-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₉H₃₈O₉

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canonical SMILES

O=C1C2=C(O)C=C(O)C(=C2OC(C=3C=C4C(OC(C5=CC=C(O)C=C5)C4C=6C=C(O)C=C(O)C6)=CC3O)C1)CC(C(=C)C)CC=C(C)C

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isomeric SMILES

C=C(C)[C@H](CC=C(C)C)Cc1c(O)cc(O)c2c1O[C@H](c1cc3c(cc1O)O[C@@H](c1ccc(O)cc1)[C@@H]3c1cc(O)cc(O)c1)CC2=O

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found in taxon

Sophora davidii

1 reference

stated in

Stilbene oligomers in roots of Sophora davidii

Sophora leachiana

1 reference

stated in

Two complex flavanones from the roots ofSophora leachiana

Identifiers

InChI

InChI=1S/C39H38O9/c1-19(2)5-6-22(20(3)4)13-28-30(43)16-32(45)37-33(46)18-34(48-39(28)37)27-15-29-35(17-31(27)44)47-38(21-7-9-24(40)10-8-21)36(29)23-11-25(41)14-26(42)12-23/h5,7-12,14-17,22,34,36,38,40-45H,3,6,13,18H2,1-2,4H3/t22-,34+,36-,38+/m1/s1

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InChIKey

DBXQAEOPCKROBN-BEZYARGNSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DBXQAEOPCKROBN-BEZYARGNSA-N

1 reference

(Q104975023)

(2S)-2-[(2R,3R)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-5-yl]-5,7-dihydroxy-8-[(2R)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]-2,3-dihydrochromen-4-one

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