(Q104913338)

English

[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl] 2,5-dihydroxybenzoate

chemical compound

In more languages

Statements

type of chemical entity

0 references

3,4,5-trihydroxyoxan-2-yl 2,5-dihydroxybenzoate

1 reference

based on heuristic

inferred from SMILES

286.068867408 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₂H₁₄O₈

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canonical SMILES

O=C(OC1OCC(O)C(O)C1O)C2=CC(O)=CC=C2O

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isomeric SMILES

O=C(O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O)c1cc(O)ccc1O

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Medicago truncatula

1 reference

Gentisic acid conjugates of Medicago truncatula roots.

Identifiers

InChI=1S/C12H14O8/c13-5-1-2-7(14)6(3-5)11(18)20-12-10(17)9(16)8(15)4-19-12/h1-3,8-10,12-17H,4H2/t8-,9+,10-,12+/m1/s1

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AJQWJTYMCZVSAR-KLBPJQLPSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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