(Q111269368)

English

(3R,3aR,6R,6aS)-6-(4-hydroxy-3-methoxyphenyl)-3-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3,3a,6,6a-tetrahydro-1H-furo[3,4-c]furan-4-one

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

534.1737264 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₀O₁₂

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canonical SMILES

O=C1OC(C2=CC=C(O)C(OC)=C2)C3COC(C4=CC=C(OC5OC(CO)C(O)C(O)C5O)C(OC)=C4)C13

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isomeric SMILES

COc1cc([C@@H]2OC(=O)[C@@H]3[C@H]2CO[C@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O

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found in taxon

Styrax japonicus

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stated in

New furofuran and butyrolactone lignans with antioxidant activity from the stem bark of Styrax japonica

Identifiers

InChI

InChI=1S/C26H30O12/c1-33-16-7-11(3-5-14(16)28)23-13-10-35-24(19(13)25(32)38-23)12-4-6-15(17(8-12)34-2)36-26-22(31)21(30)20(29)18(9-27)37-26/h3-8,13,18-24,26-31H,9-10H2,1-2H3/t13-,18-,19-,20-,21+,22-,23+,24+,26-/m1/s1

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InChIKey

REJREAKEHPGNCH-KVDZAEMRSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

REJREAKEHPGNCH-KVDZAEMRSA-N

1 reference

(Q111269368)

(3R,3aR,6R,6aS)-6-(4-hydroxy-3-methoxyphenyl)-3-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3,3a,6,6a-tetrahydro-1H-furo[3,4-c]furan-4-one

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Identifiers

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