(Q105209152)

English

Diacetic acid [(2S)-2alpha-(4-methoxy-1,3-benzodioxole-6-yl)-5alpha-(4-hydroxy-3,5-dimethoxyphenyl)tetrahydrofuran]-3beta,4alpha-diylbismethylene ester

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

518.17881178 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₀O₁₁

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canonical SMILES

O=C(OCC1C(OC(C2=CC(OC)=C3OCOC3=C2)C1COC(=O)C)C4=CC(OC)=C(O)C(OC)=C4)C

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isomeric SMILES

COc1cc([C@@H]2O[C@H](c3cc(OC)c4c(c3)OCO4)[C@@H](COC(C)=O)[C@@H]2COC(C)=O)cc(OC)c1O

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found in taxon

Peperomia dindygulensis

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stated in

Bioactive tetrahydrofuran lignans from Peperomia dindygulensis

Peperomia leptostachya

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stated in

Bioactive tetrahydrofuran lignans from Peperomia dindygulensis

Peperomia humilis

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stated in

Bioactive tetrahydrofuran lignans from Peperomia dindygulensis

Identifiers

InChI

InChI=1S/C26H30O11/c1-13(27)33-10-17-18(11-34-14(2)28)25(16-8-21(32-5)26-22(9-16)35-12-36-26)37-24(17)15-6-19(30-3)23(29)20(7-15)31-4/h6-9,17-18,24-25,29H,10-12H2,1-5H3/t17-,18-,24-,25+/m0/s1

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InChIKey

PHPSKSJVYFWRIV-AMIJONBRSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PHPSKSJVYFWRIV-AMIJONBRSA-N

1 reference

(Q105209152)

Diacetic acid [(2S)-2alpha-(4-methoxy-1,3-benzodioxole-6-yl)-5alpha-(4-hydroxy-3,5-dimethoxyphenyl)tetrahydrofuran]-3beta,4alpha-diylbismethylene ester

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Identifiers

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