(Q113960242)

English

4-[(3S,3aR,6S,6aR)-3-(3,5-dimethoxy-4-methylphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenol

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

416.183503236 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₂₈O₇

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canonical SMILES

OC1=C(OC)C=C(C=C1OC)C2OCC3C(OCC23)C4=CC(OC)=C(C(OC)=C4)C

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isomeric SMILES

COc1cc([C@H]2OC[C@@H]3[C@@H](c4cc(OC)c(O)c(OC)c4)OC[C@H]23)cc(OC)c1C

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found in taxon

Isodon ternifolius

1 reference

stated in

Anti-inflammatory lignans and phenylethanoid glycosides from the root of Isodon ternifolius (D.Don) Kudô

Identifiers

InChI

InChI=1S/C23H28O7/c1-12-17(25-2)6-13(7-18(12)26-3)22-15-10-30-23(16(15)11-29-22)14-8-19(27-4)21(24)20(9-14)28-5/h6-9,15-16,22-24H,10-11H2,1-5H3/t15-,16-,22+,23+/m0/s1

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InChIKey

UBVIKYYTVFHBGN-WVZRZZCNSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UBVIKYYTVFHBGN-WVZRZZCNSA-N

(Q113960242)

4-[(3S,3aR,6S,6aR)-3-(3,5-dimethoxy-4-methylphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenol

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Identifiers

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