(Q104995509)

English

(E)-3-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-[2-(4-Hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid

1 reference

based on heuristic

inferred from SMILES

mass

372.12090298 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S,3R)-glycosmisic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2R,3S)-glycosmisic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₀O₇

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canonical SMILES

O=C(O)C=CC=1C=C(OC)C=2OC(C3=CC=C(O)C(OC)=C3)C(C2C1)CO

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isomeric SMILES

COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C(=O)O)cc3[C@@H]2CO)ccc1O

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found in taxon

Tarenna attenuata

1 reference

stated in

Mixed lignan-neolignans from Tarenna attenuata

Identifiers

InChI

InChI=1S/C20H20O7/c1-25-16-9-12(4-5-15(16)22)19-14(10-21)13-7-11(3-6-18(23)24)8-17(26-2)20(13)27-19/h3-9,14,19,21-22H,10H2,1-2H3,(H,23,24)/b6-3+/t14-,19-/m0/s1

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InChIKey

FHYQIQMSODIFCP-SWYRVXOFSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FHYQIQMSODIFCP-SWYRVXOFSA-N

1 reference

(Q104995509)

(E)-3-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid

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Identifiers

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