(Q105261683)

English

2-(2-{[1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl}-3,4-bis(3,4-dihydroxyphenyl)cyclobutanecarbonyloxy)-3-(3,4-dihydroxyphenyl)propanoic acid

group of stereoisomers with the chemical formula C₃₆H₃₂O₁₆

In more languages

Statements

group of stereoisomers

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chemical compound

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720.1690349440001 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₆H₃₂O₁₆

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canonical SMILES

O=C(O)C(OC(=O)C1C(C(=O)OC(C(=O)O)CC2=CC=C(O)C(O)=C2)C(C3=CC=C(O)C(O)=C3)C1C4=CC=C(O)C(O)=C4)CC5=CC=C(O)C(O)=C5

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Identifiers

InChI=1S/C36H32O16/c37-19-5-1-15(9-23(19)41)11-27(33(45)46)51-35(49)31-29(17-3-7-21(39)25(43)13-17)30(18-4-8-22(40)26(44)14-18)32(31)36(50)52-28(34(47)48)12-16-2-6-20(38)24(42)10-16/h1-10,13-14,27-32,37-44H,11-12H2,(H,45,46)(H,47,48)

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SUYLTDFWHNXGDX-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

SUYLTDFWHNXGDX-UHFFFAOYSA-N

UniChem compound ID

1 reference

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

SUYLTDFWHNXGDX-UHFFFAOYSA-N

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