(Q105172652)

English

1-O,2-O-Bis[(E)-3-(3,5-dimethoxy-4-hydroxyphenyl)acryloyl]-6-O-[6-O-[(E)-3-(3,5-dimethoxy-4-hydroxyphenyl)acryloyl]-beta-D-glucopyranosyl]-beta-D-glucopyranose

chemical compound

In more languages

Statements

type of chemical entity

0 references

[6-[[3,4-Dihydroxy-5,6-bis[3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyloxy]oxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

960.289937924 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₅H₅₂O₂₃

0 references

canonical SMILES

O=C(OCC1OC(OCC2OC(OC(=O)C=CC3=CC(OC)=C(O)C(OC)=C3)C(OC(=O)C=CC4=CC(OC)=C(O)C(OC)=C4)C(O)C2O)C(O)C(O)C1O)C=CC5=CC(OC)=C(O)C(OC)=C5

0 references

isomeric SMILES

COc1cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC[C@H]3O[C@@H](OC(=O)/C=C/c4cc(OC)c(O)c(OC)c4)[C@H](OC(=O)/C=C/c4cc(OC)c(O)c(OC)c4)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O

0 references

1 reference

Formation of a complex pattern of sinapate esters in Brassica napus seeds, catalyzed by enzymes of a serine carboxypeptidase-like acyltransferase family?

Identifiers

InChI=1S/C45H52O23/c1-57-24-13-21(14-25(58-2)35(24)49)7-10-32(46)63-19-30-38(52)40(54)42(56)44(65-30)64-20-31-39(53)41(55)43(67-33(47)11-8-22-15-26(59-3)36(50)27(16-22)60-4)45(66-31)68-34(48)12-9-23-17-28(61-5)37(51)29(18-23)62-6/h7-18,30-31,38-45,49-56H,19-20H2,1-6H3/b10-7+,11-8+,12-9+/t30-,31-,38-,39-,40+,41+,42-,43-,44-,45+/m1/s1

0 references

MUQGQMDIXLYGAC-PKCRMPFFSA-N

0 references

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

MUQGQMDIXLYGAC-PKCRMPFFSA-N

UniChem compound ID

1 reference

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