(Q104911273)

English

(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[2-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]phenoxy]oxane-3,4,5-triol

chemical compound

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instance of

type of chemical entity

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subclass of

2-(Hydroxymethyl)-6-[4-[2-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]phenoxy]oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

542.16355564 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₀O₁₄

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canonical SMILES

OC1=CC(OC2OC(CO)C(O)C(O)C2O)=CC=C1OC3=CC=C(OC4OC(CO)C(O)C(O)C4O)C=C3

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isomeric SMILES

OC[C@H]1O[C@@H](Oc2ccc(Oc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O

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found in taxon

Breynia fruticosa

1 reference

stated in

Glycosides from Breynia fruticosa and Breynia rostrata

Identifiers

InChI

InChI=1S/C24H30O14/c25-8-15-17(28)19(30)21(32)23(37-15)35-11-3-1-10(2-4-11)34-14-6-5-12(7-13(14)27)36-24-22(33)20(31)18(29)16(9-26)38-24/h1-7,15-33H,8-9H2/t15-,16-,17-,18-,19+,20+,21-,22-,23-,24-/m1/s1

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InChIKey

AFJZSYKQSJGMEC-FXPCSOOLSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q104911273)

(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[2-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]phenoxy]oxane-3,4,5-triol

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Identifiers

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