(Q105268711)

English

(1S,2R,3S)-2-[(2S,3S)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-4-yl]-1-[(S)-hydroxy-(4-hydroxyphenyl)methyl]-3-(4-hydroxyphenyl)-2,3-dihydro-1H-indene-4,6-diol

chemical compound

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instance of

type of chemical entity

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subclass of

2-[3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-4-yl]-1-[hydroxy(4-hydroxyphenyl)methyl]-3-(4-hydroxyphenyl)-2,3-dihydro-1H-indene-4,6-diol

1 reference

based on heuristic

inferred from SMILES

mass

698.215197288 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,2R,3S)-2-[(2R,3R)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-4-yl]-1-[(R)-hydroxy-(4-hydroxyphenyl)methyl]-3-(4-hydroxyphenyl)-2,3-dihydro-1H-indene-4,6-diol

2 references

based on heuristic

inferred from InChIKey

1 reference

C₄₂H₃₄O₁₀

0 references

canonical SMILES

OC1=CC=C(C=C1)C(O)C2C=3C=C(O)C=C(O)C3C(C4=CC=C(O)C=C4)C2C=5C=C(O)C=C6OC(C7=CC=C(O)C=C7)C(C=8C=C(O)C=C(O)C8)C65

0 references

isomeric SMILES

Oc1ccc([C@@H](O)[C@@H]2c3cc(O)cc(O)c3[C@H](c3ccc(O)cc3)[C@H]2c2cc(O)cc3c2[C@H](c2cc(O)cc(O)c2)[C@@H](c2ccc(O)cc2)O3)cc1

0 references

found in taxon

Vatica pauciflora

1 reference

stated in

New resveratrol oligomers in the stem bark of Vatica pauciflora

Identifiers

InChI

InChI=1S/C42H34O10/c43-24-7-1-20(2-8-24)35-37-31(16-29(48)18-33(37)50)40(41(51)21-3-9-25(44)10-4-21)39(35)32-17-30(49)19-34-38(32)36(23-13-27(46)15-28(47)14-23)42(52-34)22-5-11-26(45)12-6-22/h1-19,35-36,39-51H/t35-,36-,39+,40+,41+,42+/m0/s1

0 references

InChIKey

UAFPJINRIKXWOZ-GHZFNOJXSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105268711)

(1S,2R,3S)-2-[(2S,3S)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-4-yl]-1-[(S)-hydroxy-(4-hydroxyphenyl)methyl]-3-(4-hydroxyphenyl)-2,3-dihydro-1H-indene-4,6-diol

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