(Q104939382)

English

1-[3-[(2S,3S,4aR,6R,7S,8S,8aR)-7,8-dihydroxy-2,6-bis(hydroxymethyl)-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxin-3-yl]-2,4,6-trihydroxyphenyl]ethanone

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

402.116211524 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₂O₁₁

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canonical SMILES

O=C(C1=C(O)C=C(O)C(=C1O)C2OC3OC(CO)C(O)C(O)C3OC2CO)C

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isomeric SMILES

CC(=O)c1c(O)cc(O)c([C@@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@H]2CO)c1O

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found in taxon

Eriocapitella tomentosa

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stated in

Two Glycosides and Other Constituents from Anemone tomentosa Roots

Identifiers

InChI

InChI=1S/C17H22O11/c1-5(20)10-6(21)2-7(22)11(13(10)24)15-9(4-19)26-16-14(25)12(23)8(3-18)27-17(16)28-15/h2,8-9,12,14-19,21-25H,3-4H2,1H3/t8-,9+,12-,14+,15-,16-,17+/m1/s1

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InChIKey

BOPNBEMHPYANDR-QSHXVNPLSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q104939382)

1-[3-[(2S,3S,4aR,6R,7S,8S,8aR)-7,8-dihydroxy-2,6-bis(hydroxymethyl)-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxin-3-yl]-2,4,6-trihydroxyphenyl]ethanone

Statements

Identifiers

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