(Q105175275)

English

5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one

group of stereoisomers with the chemical formula C₂₁H₂₀O₁₀

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Statements

instance of

group of stereoisomers

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subclass of

6C-glycosylated flavone

1 reference

inferred from

6C-glycosylated flavone

6C-substituted flavone

1 reference

inferred from

6C-substituted flavone

mass

432.10564684 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₀O₁₀

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canonical SMILES

O=C1C=C(OC2=CC(O)=C(C(O)=C12)C3OC(CO)C(O)C(O)C3O)C=4C=CC(O)=CC4

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isomeric SMILES

O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3OC(CO)[C@@H](O)C(O)[C@@H]3O)c(O)c12

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found in taxon

Oreopanax guatemalensis

1 reference

stated in

Triterpenoid saponins from Oreopanax guatemalensis.

Identifiers

InChI

InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14?,17-,19?,20+,21+/m1/s1

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InChIKey

MYXNWGACZJSMBT-RAFLFOFHSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MYXNWGACZJSMBT-RAFLFOFHSA-N

1 reference

(Q105175275)

5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one

Statements

Identifiers

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