(Q113960241)

English

[(2R)-3-(3,4-dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl] 4-(3,4-dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carboxylate

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

506.121296904 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₂₂O₁₀

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canonical SMILES

O=C(OC(C(=O)OC)CC1=CC=C(O)C(O)=C1)C2=CC=3C=C(O)C(O)=CC3C(=C2)C=4C=CC(O)=C(O)C4

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isomeric SMILES

COC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)c1cc(-c2ccc(O)c(O)c2)c2cc(O)c(O)cc2c1

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found in taxon

Isodon ternifolius

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stated in

Anti-inflammatory lignans and phenylethanoid glycosides from the root of Isodon ternifolius (D.Don) Kudô

Identifiers

InChI

InChI=1S/C27H22O10/c1-36-27(35)25(7-13-2-4-19(28)21(30)6-13)37-26(34)16-8-15-11-23(32)24(33)12-18(15)17(9-16)14-3-5-20(29)22(31)10-14/h2-6,8-12,25,28-33H,7H2,1H3/t25-/m1/s1

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InChIKey

VFAUZMGCZPAFDV-RUZDIDTESA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VFAUZMGCZPAFDV-RUZDIDTESA-N

(Q113960241)

[(2R)-3-(3,4-dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl] 4-(3,4-dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carboxylate

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Identifiers

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