(Q105161569)

English

(E)-3-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enoic acid

chemical compound

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instance of

type of chemical entity

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subclass of

3-[2-(4-Hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enoic acid

1 reference

based on heuristic

inferred from SMILES

mass

358.105252916 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(E)-3-[(2S,3S)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enoic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₉H₁₈O₇

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canonical SMILES

O=C(O)C=CC1=CC=C2OC(C3=CC=C(O)C(OC)=C3)C(OC2=C1)CO

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isomeric SMILES

COc1cc([C@H]2Oc3ccc(/C=C/C(=O)O)cc3O[C@@H]2CO)ccc1O

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found in taxon

Morinda citrifolia

1 reference

stated in

Protein tyrosine phosphatase 1B (PTP1B) inhibitors from Morinda citrifolia (Noni) and their insulin mimetic activity

Identifiers

InChI

InChI=1S/C19H18O7/c1-24-15-9-12(4-5-13(15)21)19-17(10-20)25-16-8-11(3-7-18(22)23)2-6-14(16)26-19/h2-9,17,19-21H,10H2,1H3,(H,22,23)/b7-3+/t17-,19-/m1/s1

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InChIKey

MDAPOPYYLXOSPU-GHAAFOEMSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MDAPOPYYLXOSPU-GHAAFOEMSA-N

1 reference

(Q105161569)

(E)-3-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enoic acid

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