3-[3,4-bis(oxidanyl)phenyl]-2-[[2-[3,4-bis(oxidanyl)phenyl]-4-[2-[[2-[3,4-bis(oxidanyl)phenyl]-4-[2-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-3-oxidanyl-3-oxidanylidene-propyl]-7-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]carbonyloxy]-3-oxidanyl-3-oxidanylidene-propyl]-7-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]carbonyloxy]propanoic acid

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-2-[[2-[3,4-bis(oxidanyl)phenyl]-4-[2-[[2-[3,4-bis(oxidanyl)phenyl]-4-[2-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-3-oxidanyl-3-oxidanylidene-propyl]-7-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]carbonyloxy]-3-oxidanyl-3-oxidanylidene-propyl]-7-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]carbonyloxy]propanoic acid Openeye Name: 3-(3,4-dihydroxyphenyl)-2-[2-(3,4-dihydroxyphenyl)-4-[2-[2-(3,4-dihydroxyphenyl)-4-[2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxy-3-oxo-propyl]-7-hydroxy-2,3-dihydrobenzofuran-3-carbonyl]oxy-3-hydroxy-3-oxo-propyl]-7-hydroxy-2,3-dihydrobenzofuran-3-carbonyl]oxy-propanoic acid CAS Name: 3-(3,4-dihydroxyphenyl)-2-[[2-(3,4-dihydroxyphenyl)-4-[2-[[2-(3,4-dihydroxyphenyl)-4-[2-[(E)-3-(3,4-dihydroxyphenyl)-1-oxoprop-2-enoxy]-3-hydroxy-3-oxopropyl]-7-hydroxy-2,3-dihydrobenzofuran-3-yl]-oxomethoxy]-3-hydroxy-3-oxopropyl]-7-hydroxy-2,3-dihydrobenzofuran-3-yl]-oxomethoxy]propanoic acid IUPAC Name: 3-(3,4-dihydroxyphenyl)-2-[2-(3,4-dihydroxyphenyl)-4-[2-[2-(3,4-dihydroxyphenyl)-4-[2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxy-3-oxopropyl]-7-hydroxy-2,3-dihydro-1-benzofuran-3-carbonyl]oxy-3-hydroxy-3-oxopropyl]-7-hydroxy-2,3-dihydro-1-benzofuran-3-carbonyl]oxypropanoic acid Traditional Name: 3-(3,4-dihydroxyphenyl)-2-[2-(3,4-dihydroxyphenyl)-4-[2-[2-(3,4-dihydroxyphenyl)-4-[2-[(E)-3-(3,4-dihydroxyphenyl)acryloyl]oxy-3-hydroxy-3-keto-propyl]-7-hydroxy-coumaran-3-carbonyl]oxy-3-hydroxy-3-keto-propyl]-7-hydroxy-coumaran-3-carbonyl]oxy-propionic acid Formula: C54H44O24 MolecularWeight: 1076.91276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C2C(OC3=C(C=CC(=C23)CC(C(=O)O)OC(=O)C4C(OC5=C(C=CC(=C45)CC(C(=O)O)OC(=O)C=CC6=CC(=C(C=C6)O)O)O)C7=CC(=C(C=C7)O)O)O)C8=CC(=C(C=C8)O)O)O)O

Isomeric SMILES

C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C2C(OC3=C(C=CC(=C23)CC(C(=O)O)OC(=O)C4C(OC5=C(C=CC(=C45)CC(C(=O)O)OC(=O)/C=C/C6=CC(=C(C=C6)O)O)O)C7=CC(=C(C=C7)O)O)O)C8=CC(=C(C=C8)O)O)O)O

InChI

InChI=1S/C54H44O24/c55-28-8-1-22(15-34(28)61)3-14-41(65)74-39(51(68)69)20-24-4-12-32(59)48-42(24)45(47(78-48)27-7-11-31(58)37(64)19-27)54(73)76-40(52(70)71)21-25-5-13-33(60)49-43(25)44(46(77-49)26-6-10-30(57)36(63)18-26)53(72)75-38(50(66)67)17-23-2-9-29(56)35(62)16-23/h1-16,18-19,38-40,44-47,55-64H,17,20-21H2,(H,66,67)(H,68,69)(H,70,71)/b14-3+