(Q105165563)

English

[(2R)-2-hydroxy-2-[(2R,3S,4S,5R)-3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]ethyl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

chemical compound

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instance of

type of chemical entity

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subclass of

[2-Hydroxy-2-[3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]ethyl] 3-(3,4-dihydroxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

372.10564684 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₆H₂₀O₁₀

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canonical SMILES

O=C(OCC(O)C1OC(O)(CO)C(O)C1O)C=CC2=CC=C(O)C(O)=C2

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isomeric SMILES

O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H](O)[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O

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found in taxon

Nyssa sylvatica

1 reference

stated in

7-Caffeoylsedoheptulose from Nyssa sylvatica

Identifiers

InChI

InChI=1S/C16H20O10/c17-7-16(24)15(23)13(22)14(26-16)11(20)6-25-12(21)4-2-8-1-3-9(18)10(19)5-8/h1-5,11,13-15,17-20,22-24H,6-7H2/b4-2+/t11-,13-,14-,15+,16-/m1/s1

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InChIKey

MJOZYOYVRKCTGK-LPJNGZMXSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MJOZYOYVRKCTGK-LPJNGZMXSA-N

(Q105165563)

[(2R)-2-hydroxy-2-[(2R,3S,4S,5R)-3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]ethyl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

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