(Q104985015)

English

(2R,3R,4S)-2-(3-hydroxy-4-methoxyphenyl)-3-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-chromene-4,5,7-triol

chemical compound

In more languages

Statements

type of chemical entity

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482.142426272 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₆O₁₂

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canonical SMILES

OC=1C=C(O)C2=C(OC(C3=CC=C(OC)C(O)=C3)C(OC4OC(CO)C(O)C(O)C4O)C2O)C1

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isomeric SMILES

COc1ccc([C@H]2Oc3cc(O)cc(O)c3[C@H](O)[C@H]2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1O

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Cassia javanica

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The flavonoids of Cassia javanica flowers

Identifiers

InChI=1S/C22H26O12/c1-31-12-3-2-8(4-10(12)25)20-21(17(28)15-11(26)5-9(24)6-13(15)32-20)34-22-19(30)18(29)16(27)14(7-23)33-22/h2-6,14,16-30H,7H2,1H3/t14-,16-,17-,18-,19+,20+,21+,22-/m0/s1

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DMBGBBGTHCUWFV-NTGPHHKDSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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