(Q105255690)

English

[(R)-4-(3,4-Dimethoxyphenyl)-1-[(S)-alpha,3,4-trimethoxybenzyl]-3-butynyl]beta-D-glucopyranoside

chemical compound

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instance of

type of chemical entity

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subclass of

2-[1,5-Bis(3,4-dimethoxyphenyl)-1-methoxypent-4-yn-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

548.225761972 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₆O₁₁

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canonical SMILES

OCC1OC(OC(CC#CC2=CC=C(OC)C(OC)=C2)C(OC)C3=CC=C(OC)C(OC)=C3)C(O)C(O)C1O

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isomeric SMILES

COc1ccc(C#CC[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](OC)c2ccc(OC)c(OC)c2)cc1OC

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found in taxon

Molineria capitulata

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stated in

Three novel constituents from curculigo capitulata and revision of C-2 stereochemistry in nyasicoside

Curculigo capitulata

1 reference

stated in

Three novel constituents from curculigo capitulata and revision of C-2 stereochemistry in nyasicoside

Identifiers

InChI

InChI=1S/C28H36O11/c1-33-18-11-9-16(13-21(18)35-3)7-6-8-20(38-28-26(32)25(31)24(30)23(15-29)39-28)27(37-5)17-10-12-19(34-2)22(14-17)36-4/h9-14,20,23-32H,8,15H2,1-5H3/t20-,23-,24-,25+,26-,27+,28-/m1/s1

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InChIKey

SLWIUACHMZHULA-OKKVRJOVSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105255690)

[(R)-4-(3,4-Dimethoxyphenyl)-1-[(S)-alpha,3,4-trimethoxybenzyl]-3-butynyl]beta-D-glucopyranoside

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