(Q105310700)

English

(2S)-2alpha-(3,5-Dimethoxy-4-hydroxyphenyl)-3beta-[6-O-[(Z)-3-(3-methoxy-4-hydroxyphenyl)acryloyl]-beta-D-glucopyranosyloxymethyl]-4beta-(3,5-dimethoxy-4-hydroxybenzyl)tetrahydrofuran

chemical compound

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instance of

type of chemical entity

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subclass of

[3,4,5-Trihydroxy-6-[[2-(4-hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-3-yl]methoxy]oxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

758.278585392 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S)-2alpha-(3,5-Dimethoxy-4-hydroxyphenyl)-3beta-[6-O-[(E)-3-(3-methoxy-4-hydroxyphenyl)acryloyl]-beta-D-glucopyranosyloxymethyl]-4beta-(3,5-dimethoxy-4-hydroxybenzyl)tetrahydrofuran

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₈H₄₆O₁₆

0 references

canonical SMILES

O=C(OCC1OC(OCC2C(OCC2CC3=CC(OC)=C(O)C(OC)=C3)C4=CC(OC)=C(O)C(OC)=C4)C(O)C(O)C1O)C=CC5=CC=C(O)C(OC)=C5

0 references

isomeric SMILES

COc1cc(/C=C\C(=O)OC[C@H]2O[C@@H](OC[C@@H]3[C@@H](c4cc(OC)c(O)c(OC)c4)OC[C@@H]3Cc3cc(OC)c(O)c(OC)c3)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O

0 references

found in taxon

Asclepias curassavica

1 reference

stated in

New cardenolide and acylated lignan glycosides from the aerial parts of Asclepias curassavica

Identifiers

InChI

InChI=1S/C38H46O16/c1-46-25-11-19(6-8-24(25)39)7-9-31(40)51-18-30-34(43)35(44)36(45)38(54-30)53-17-23-22(10-20-12-26(47-2)32(41)27(13-20)48-3)16-52-37(23)21-14-28(49-4)33(42)29(15-21)50-5/h6-9,11-15,22-23,30,34-39,41-45H,10,16-18H2,1-5H3/b9-7-/t22-,23-,30+,34+,35-,36+,37+,38+/m0/s1

0 references

InChIKey

WQGFZONMTGYTJZ-MJRUUCJPSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WQGFZONMTGYTJZ-MJRUUCJPSA-N

1 reference

(Q105310700)

(2S)-2alpha-(3,5-Dimethoxy-4-hydroxyphenyl)-3beta-[6-O-[(Z)-3-(3-methoxy-4-hydroxyphenyl)acryloyl]-beta-D-glucopyranosyloxymethyl]-4beta-(3,5-dimethoxy-4-hydroxybenzyl)tetrahydrofuran

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Identifiers

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