(Q105036274)

English

3-O-[3-(4-Hydroxy-3-methoxyphenyl)acryloyl]-4-O-acetyl-beta-D-fructofuranosyl 4-O-acetyl-6-O-[3-(4-hydroxy-3-methoxyphenyl)acryloyl]-alpha-D-glucopyranoside

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[3-Acetyloxy-6-[4-acetyloxy-3-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

778.232029124 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₄₂O₁₉

0 references

canonical SMILES

O=C(OCC1OC(OC2(OC(CO)C(OC(=O)C)C2OC(=O)C=CC3=CC=C(O)C(OC)=C3)CO)C(O)C(O)C1OC(=O)C)C=CC4=CC=C(O)C(OC)=C4

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isomeric SMILES

COc1cc(/C=C/C(=O)OC[C@H]2O[C@H](O[C@]3(CO)O[C@H](CO)[C@@H](OC(C)=O)[C@@H]3OC(=O)/C=C/c3ccc(O)c(OC)c3)[C@H](O)[C@@H](O)[C@@H]2OC(C)=O)ccc1O

0 references

found in taxon

Lilium mackliniae

1 reference

stated in

Studies on the Chemical Constituents of the Bulbs of Lilium mackliniae.

Identifiers

InChI

InChI=1S/C36H42O19/c1-18(39)50-32-27(16-49-28(43)11-7-20-5-9-22(41)24(13-20)47-3)52-35(31(46)30(32)45)55-36(17-38)34(33(51-19(2)40)26(15-37)54-36)53-29(44)12-8-21-6-10-23(42)25(14-21)48-4/h5-14,26-27,30-35,37-38,41-42,45-46H,15-17H2,1-4H3/b11-7+,12-8+/t26-,27-,30-,31-,32-,33-,34+,35-,36+/m1/s1

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InChIKey

IATDAONUNUCWNX-FVDAWXQDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IATDAONUNUCWNX-FVDAWXQDSA-N

1 reference

(Q105036274)

3-O-[3-(4-Hydroxy-3-methoxyphenyl)acryloyl]-4-O-acetyl-beta-D-fructofuranosyl 4-O-acetyl-6-O-[3-(4-hydroxy-3-methoxyphenyl)acryloyl]-alpha-D-glucopyranoside

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Identifiers

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