(Q105134577)

English

5,7-dihydroxy-2-[(1r,4r)-1-hydroxy-4-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohexa-2,5-dien-1-yl]chromen-4-one

chemical compound

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Statements

type of chemical entity

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5,7-Dihydroxy-2-[1-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexa-2,5-dien-1-yl]chromen-4-one

1 reference

based on heuristic

inferred from SMILES

450.116211524 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₂O₁₁

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canonical SMILES

O=C1C=C(OC=2C=C(O)C=C(O)C12)C3(O)C=CC(OC4OC(CO)C(O)C(O)C4O)C=C3

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isomeric SMILES

O=c1cc([C@]2(O)C=C[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C2)oc2cc(O)cc(O)c12

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Macrothelypteris torresiana

1 reference

New cytotoxic flavonoids from Thelypteris torresiana

Identifiers

InChI=1S/C21H22O11/c22-8-14-17(26)18(27)19(28)20(32-14)30-10-1-3-21(29,4-2-10)15-7-12(25)16-11(24)5-9(23)6-13(16)31-15/h1-7,10,14,17-20,22-24,26-29H,8H2/t10-,14-,17-,18+,19-,20-,21-/m1/s1

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JSUSPSWATHLLME-ALLOUVLESA-N

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