(Q110184749)

English

4-[(3,4-dimethoxyphenyl)methyl]-3-[[3-methoxy-4-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one

group of stereoisomers with the chemical formula C₂₇H₃₄O₁₁

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

534.210111908 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₃₄O₁₁

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canonical SMILES

O=C1OCC(CC2=CC=C(OC)C(OC)=C2)C1CC3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(OC)=C3

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isomeric SMILES

COc1ccc(CC2COC(=O)C2Cc2ccc(OC3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc1OC

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found in taxon

Cynara cardunculus

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stated in

Constituents of Cynara cardunculus

Identifiers

InChI

InChI=1S/C27H34O11/c1-33-18-6-4-14(10-20(18)34-2)8-16-13-36-26(32)17(16)9-15-5-7-19(21(11-15)35-3)37-27-25(31)24(30)23(29)22(12-28)38-27/h4-7,10-11,16-17,22-25,27-31H,8-9,12-13H2,1-3H3/t16?,17?,22-,23-,24+,25-,27?/m1/s1

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InChIKey

XOJVHLIYNSOZOO-XDVOEGGCSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XOJVHLIYNSOZOO-XDVOEGGCSA-N

(Q110184749)

4-[(3,4-dimethoxyphenyl)methyl]-3-[[3-methoxy-4-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one

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Identifiers

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