(Q104963499)

English

3-[(2S,3R,4S,5S,6S)-6-[2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-2-methyloxan-3-yl]oxy-3-oxopropanoic acid

chemical compound

In more languages

Statements

type of chemical entity

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564.111520068 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₂₄O₁₅

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canonical SMILES

O=C(O)CC(=O)OC1C(O)C(O)C(OC=2C(=O)C=3C(O)=CC(O)=CC3OC2C=4C=C(O)C(O)=C(OC)C4)OC1C

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isomeric SMILES

COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](OC(=O)CC(=O)O)[C@@H](O)[C@@H]2O)cc(O)c1O

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1 reference

Three new flavonol malonylrhamnosides from Ribes alpinum

Identifiers

InChI=1S/C25H24O15/c1-8-22(39-16(31)7-15(29)30)20(34)21(35)25(37-8)40-24-19(33)17-11(27)5-10(26)6-13(17)38-23(24)9-3-12(28)18(32)14(4-9)36-2/h3-6,8,20-22,25-28,32,34-35H,7H2,1-2H3,(H,29,30)/t8-,20-,21-,22-,25-/m0/s1

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CLJHAXXQLXXEAX-TZUKPBLKSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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