(Q105323067)

English

3-oxo-3-[[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-5-yl]oxyoxan-2-yl]methoxy]propanoic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

flavone

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mass

532.121690828 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₂₄O₁₃

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canonical SMILES

O=C(O)CC(=O)OCC1OC(OC=2C=C(OC)C=C3OC(=CC(=O)C32)C=4C=CC(O)=CC4)C(O)C(O)C1O

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isomeric SMILES

COc1cc(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@H](O)[C@H](O)[C@@H]2O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1

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found in taxon

Equisetum arvense

1 reference

stated in

Malonylated flavone 5-O-glucosides in the barren sprouts of Equisetum arvense

Identifiers

InChI

InChI=1S/C25H24O13/c1-34-13-6-16-21(14(27)8-15(36-16)11-2-4-12(26)5-3-11)17(7-13)37-25-24(33)23(32)22(31)18(38-25)10-35-20(30)9-19(28)29/h2-8,18,22-26,31-33H,9-10H2,1H3,(H,28,29)/t18-,22+,23+,24+,25-/m1/s1

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InChIKey

WZEYEVDCZWOQJH-FYOOOJEWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WZEYEVDCZWOQJH-FYOOOJEWSA-N

(Q105323067)

3-oxo-3-[[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-5-yl]oxyoxan-2-yl]methoxy]propanoic acid

Statements

Identifiers

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