(Q105314773)

English

(1R,5R,6R)-6-[4-[2-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethoxy]-3,5-dimethoxyphenyl]-3,7-dioxabicyclo[3.3.0]octane-2-one

group of stereoisomers with the chemical formula C₂₄H₂₈O₁₀

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Statements

group of stereoisomers

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chemical compound

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476.168247096 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₄H₂₈O₁₀

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canonical SMILES

O=C1OCC2C(OCC12)C3=CC(OC)=C(OC(CO)C(O)C4=CC=C(O)C(OC)=C4)C(OC)=C3

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isomeric SMILES

COc1cc(C(O)C(CO)Oc2c(OC)cc([C@@H]3OC[C@@H]4C(=O)OC[C@@H]43)cc2OC)ccc1O

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Tarenna attenuata

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Mixed lignan-neolignans from Tarenna attenuata

Identifiers

InChI=1S/C24H28O10/c1-29-17-6-12(4-5-16(17)26)21(27)20(9-25)34-23-18(30-2)7-13(8-19(23)31-3)22-14-10-33-24(28)15(14)11-32-22/h4-8,14-15,20-22,25-27H,9-11H2,1-3H3/t14-,15-,20?,21?,22-/m0/s1

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WXNHVUOGFJILRR-YGAXPAPJSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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