(Q105350862)

English

[13-[4-[3-(3,4-Dihydroxyphenyl)propanoyl]-3,5-dihydroxyphenoxy]-3,4,5,12,21,22,23-heptahydroxy-8,18-dioxo-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-11-yl] 3,4,5-trihydroxybenzoate

group of stereoisomers with the chemical formula C₄₂H₃₄O₂₃

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instance of

group of stereoisomers

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1 reference

906.7072 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₄₂H₃₄O₂₃

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canonical SMILES

O=C1OCC2OC(OC3=CC(O)=C(C(=O)CCC4=CC=C(O)C(O)=C4)C(O)=C3)C(O)C(OC(=O)C5=CC(O)=C(O)C(O)=C5)C2OC(=O)C6=CC(O)=C(O)C(O)=C6C=7C(O)=C(O)C(O)=CC17

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Identifiers

InChI

InChI=1S/C42H34O23/c43-18-3-1-13(5-20(18)45)2-4-19(44)30-21(46)8-15(9-22(30)47)62-42-36(57)38(65-39(58)14-6-23(48)31(52)24(49)7-14)37-27(63-42)12-61-40(59)16-10-25(50)32(53)34(55)28(16)29-17(41(60)64-37)11-26(51)33(54)35(29)56/h1,3,5-11,27,36-38,42-43,45-57H,2,4,12H2

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InChIKey

YNBDQLUEUISRRZ-UHFFFAOYSA-N

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PubChem CID

72814382

1 reference

based on heuristic

inferred from InChIKey

(Q105350862)

[13-[4-[3-(3,4-Dihydroxyphenyl)propanoyl]-3,5-dihydroxyphenoxy]-3,4,5,12,21,22,23-heptahydroxy-8,18-dioxo-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-11-yl] 3,4,5-trihydroxybenzoate

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