(Q105141612)

English

[(2S,3R,4S,5R,6R)-2-[(Z)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

chemical compound

In more languages

Statements

type of chemical entity

0 references

[2-[3-(3,4-Dihydroxyphenyl)prop-2-enoyloxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

504.126776208 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

beta-D-Glucopyranose 1,3-bis(3,4-dihydroxy-trans-cinnamate)

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₂₄O₁₂

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canonical SMILES

O=C(OC1OC(CO)C(O)C(OC(=O)C=CC2=CC=C(O)C(O)=C2)C1O)C=CC3=CC=C(O)C(O)=C3

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isomeric SMILES

O=C(/C=C\c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1O

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Balanophora japonica

1 reference

Caffeoyl, coumaroyl, galloyl, and hexahydroxydiphenoyl glucoses from Balanophora japonica.

Identifiers

InChI=1S/C24H24O12/c25-11-18-21(32)23(35-19(30)7-3-12-1-5-14(26)16(28)9-12)22(33)24(34-18)36-20(31)8-4-13-2-6-15(27)17(29)10-13/h1-10,18,21-29,32-33H,11H2/b7-3+,8-4-/t18-,21-,22-,23+,24+/m1/s1

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KIODQZXMNGIVNL-LFKFDMIISA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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