(Q105292894)

English

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl (E)-3-(4-methoxyphenyl)prop-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[3,4,5-Trihydroxy-6-[5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl 3-(4-methoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

652.179205704 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₃₂O₁₄

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canonical SMILES

O=C(OCC1OC(OC2=CC(O)=C3C(=O)C=C(OC3=C2)C=4C=C(OC)C(O)=C(OC)C4)C(O)C(O)C1O)C=CC5=CC=C(OC)C=C5

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isomeric SMILES

COc1ccc(/C=C/C(=O)OC[C@H]2O[C@@H](Oc3cc(O)c4c(=O)cc(-c5cc(OC)c(O)c(OC)c5)oc4c3)[C@H](O)[C@@H](O)[C@@H]2O)cc1

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found in taxon

Saccharum officinarum

1 reference

stated in

Antiproliferative and antioxidant activities of a tricin acylated glycoside from sugarcane (Saccharum officinarum) juice.

Identifiers

InChI

InChI=1S/C33H32O14/c1-41-18-7-4-16(5-8-18)6-9-27(36)44-15-26-30(38)31(39)32(40)33(47-26)45-19-12-20(34)28-21(35)14-22(46-23(28)13-19)17-10-24(42-2)29(37)25(11-17)43-3/h4-14,26,30-34,37-40H,15H2,1-3H3/b9-6+/t26-,30-,31+,32-,33-/m1/s1

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InChIKey

VTNUTOODDKOWQP-ZRPPFLATSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VTNUTOODDKOWQP-ZRPPFLATSA-N

1 reference

(Q105292894)

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl (E)-3-(4-methoxyphenyl)prop-2-enoate

Statements

Identifiers

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