(Q105200694)

English

[(2R,3S)-2-(4-hydroxy-3-methoxyphenyl)-5-(3-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}propyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

chemical compound

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type of chemical entity

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712.25197672 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

3-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

3-[(2S,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propyl (Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₀H₄₀O₁₂

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canonical SMILES

O=C(OCCCC1=CC(OC)=C2OC(C3=CC=C(O)C(OC)=C3)C(C2=C1)COC(=O)C=CC4=CC=C(O)C(OC)=C4)C=CC5=CC=C(O)C(OC)=C5

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isomeric SMILES

COc1cc(/C=C/C(=O)OCCCc2cc(OC)c3c(c2)[C@@H](COC(=O)/C=C/c2ccc(O)c(OC)c2)[C@H](c2ccc(O)c(OC)c2)O3)ccc1O

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found in taxon

Durio zibethinus

2 references

stated in

Secondary Metabolites from the Wood Bark ofDuriozibethinusandDuriokutejensis

stated in

Secondary Metabolites from the Wood Bark ofDuriozibethinusandDuriokutejensis

Hibiscus taiwanensis

3 references

stated in

Constituents from the stems of Hibiscus taiwanensis.

stated in

Constituents from the Stems of Hibiscus taiwanensis.

stated in

Cytotoxicity of phenylpropanoid esters from the stems of Hibiscus taiwanensis

Hibiscus cannabinus

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stated in

Phenolic constituents from the core of kenaf (Hibiscus cannabinus).

Ochroma pyramidale

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stated in

Lignans from Ochroma lagopus Swartz

Abelmoschus ficulneus

1 reference

stated in

Boehmenan, a lignan from Hibiscus ficulneus, showed Wnt signal inhibitory activity

Durio carinatus

1 reference

stated in

Lignans and Triterpenes from the Bark ofDurio carinatusandDurio oxleyanus

Durio oxleyanus

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stated in

Lignans and Triterpenes from the Bark ofDurio carinatusandDurio oxleyanus

Ochroma lagopus

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stated in

Lignans from Ochroma lagopus Swartz

Identifiers

InChI

InChI=1S/C40H40O12/c1-46-33-19-24(7-12-30(33)41)9-15-37(44)50-17-5-6-26-18-28-29(23-51-38(45)16-10-25-8-13-31(42)34(20-25)47-2)39(52-40(28)36(21-26)49-4)27-11-14-32(43)35(22-27)48-3/h7-16,18-22,29,39,41-43H,5-6,17,23H2,1-4H3/b15-9+,16-10+/t29-,39+/m1/s1

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InChIKey

OVFZHMPISOASDF-CIQYAKOOSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OVFZHMPISOASDF-CIQYAKOOSA-N

1 reference

(Q105200694)

[(2R,3S)-2-(4-hydroxy-3-methoxyphenyl)-5-(3-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}propyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

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