(Q105111862)

English

methyl (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(2S)-5-hydroxy-2-(2-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-7-yl]oxy]oxane-2-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

Methyl 3,4,5-trihydroxy-6-[[5-hydroxy-2-(2-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-7-yl]oxy]oxane-2-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

462.116211524 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₂O₁₁

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canonical SMILES

O=C(OC)C1OC(OC2=CC(O)=C3C(=O)CC(OC3=C2)C=4C=CC=CC4O)C(O)C(O)C1O

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isomeric SMILES

COC(=O)[C@H]1O[C@@H](Oc2cc(O)c3c(c2)O[C@H](c2ccccc2O)CC3=O)[C@H](O)[C@@H](O)[C@@H]1O

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found in taxon

Scutellaria ramosissima

1 reference

stated in

Flavonoids of the epigeal part of Scutellaria ramosissima

Identifiers

InChI

InChI=1S/C22H22O11/c1-30-21(29)20-18(27)17(26)19(28)22(33-20)31-9-6-12(24)16-13(25)8-14(32-15(16)7-9)10-4-2-3-5-11(10)23/h2-7,14,17-20,22-24,26-28H,8H2,1H3/t14-,17-,18-,19+,20-,22+/m0/s1

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InChIKey

IENACIKURRXMBA-QBUJOIIVSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IENACIKURRXMBA-QBUJOIIVSA-N

1 reference

(Q105111862)

methyl (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(2S)-5-hydroxy-2-(2-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-7-yl]oxy]oxane-2-carboxylate

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