(Q105020186)

English

4-[(3S,3aR,6S,6aR)-3-[(2S,3S)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenol

chemical compound

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type of chemical entity

0 references

1 reference

566.215197288 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₃₄O₁₀

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canonical SMILES

OC1=CC=C(C=C1OC)C2OC3=C(OC)C=C(C=C3C2CO)C4OCC5C(OCC45)C6=CC(OC)=C(O)C(OC)=C6

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isomeric SMILES

COc1cc([C@H]2Oc3c(OC)cc([C@H]4OC[C@@H]5[C@@H](c6cc(OC)c(O)c(OC)c6)OC[C@H]45)cc3[C@H]2CO)ccc1O

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found in taxon

Hedyotis lawsoniae

1 reference

stated in

Studies on the constituents of medicinal and related plants in Sri Lanka. III. Novel sesquilignans from Hedyotis lawsoniae.

Identifiers

InChI

InChI=1S/C31H34O10/c1-35-23-8-15(5-6-22(23)33)30-19(12-32)18-7-16(11-26(38-4)31(18)41-30)28-20-13-40-29(21(20)14-39-28)17-9-24(36-2)27(34)25(10-17)37-3/h5-11,19-21,28-30,32-34H,12-14H2,1-4H3/t19-,20+,21+,28-,29-,30-/m1/s1

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InChIKey

GUIWQKQGHGGCDZ-DYVPDTJLSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105020186)

4-[(3S,3aR,6S,6aR)-3-[(2S,3S)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenol

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