(Q105241738)

English

[6-(Acetyloxymethyl)-2-[4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy-6-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl] 3-(4-hydroxyphenyl)prop-2-enoate

group of stereoisomers with the chemical formula C₃₉H₄₀O₁₉

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instance of

group of stereoisomers

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812.725 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₉H₄₀O₁₉

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canonical SMILES

O=C(OC1C(OC(COC(=O)C)C(O)C1O)OC2C(OC3=CC(O)=C4C(=O)C=C(OC4=C3)C=5C=CC(O)=C(OC)C5)OC(CO)C(O)C2O)C=CC6=CC=C(O)C=C6

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Identifiers

InChI

InChI=1S/C39H40O19/c1-17(41)52-16-29-33(48)35(50)36(57-30(46)10-5-18-3-7-20(42)8-4-18)39(56-29)58-37-34(49)32(47)28(15-40)55-38(37)53-21-12-23(44)31-24(45)14-25(54-27(31)13-21)19-6-9-22(43)26(11-19)51-2/h3-14,28-29,32-40,42-44,47-50H,15-16H2,1-2H3

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InChIKey

RNPGTFZSTFNLEF-UHFFFAOYSA-N

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PubChem CID

73803954

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

RNPGTFZSTFNLEF-UHFFFAOYSA-N

(Q105241738)

[6-(Acetyloxymethyl)-2-[4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy-6-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl] 3-(4-hydroxyphenyl)prop-2-enoate

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