(Q110200361)

English

6',11-Bis[3-[1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]-3-oxoprop-1-enyl]-3',9-bis(3,4-dihydroxyphenyl)-6-hydroxy-7'-oxospiro[3,5-dioxatricyclo[5.2.2.02,6]undec-10-ene-4,8'-bicyclo[2.2.2]oct-5-ene]-2',8-dicarboxylic acid

group of stereoisomers with the chemical formula C₅₄H₄₆O₂₄

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Statements

group of stereoisomers

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chemical compound

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1,078.2379023520007 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₅₄H₄₆O₂₄

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canonical SMILES

O=C(O)C(OC(=O)C=CC1=CC2C(C3=CC=C(O)C(O)=C3)C(C(=O)O)C1C(=O)C42OC5C6C=C(C=CC(=O)OC(C(=O)O)CC7=CC=C(O)C(O)=C7)C(C(C(=O)O)C6C8=CC=C(O)C(O)=C8)C5(O)O4)CC9=CC=C(O)C(O)=C9

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Identifiers

InChI=1S/C54H46O24/c55-29-7-1-21(13-33(29)59)15-37(49(66)67)75-39(63)11-5-23-18-28-42(25-4-10-32(58)36(62)20-25)44(51(70)71)43(23)47(65)54(28)77-48-27-17-26(6-12-40(64)76-38(50(68)69)16-22-2-8-30(56)34(60)14-22)46(53(48,74)78-54)45(52(72)73)41(27)24-3-9-31(57)35(61)19-24/h1-14,17-20,27-28,37-38,41-46,48,55-62,74H,15-16H2,(H,66,67)(H,68,69)(H,70,71)(H,72,73)

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WLRPCCKPZVGSQJ-UHFFFAOYSA-N

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1 reference

based on heuristic

inferred from InChIKey

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