sodium [1,4-bis(4-hydroxyphenyl)-3-[2-(4-hydroxyphenyl)ethyl]-2-[1-(4-hydroxyphenyl)-2-methoxy-2-oxidanylidene-ethyl]-5-oxidanyl-6H-pyrrolo[3,2-g]carbazol-7-yl] sulfate

Systemtic Name: sodium [1,4-bis(4-hydroxyphenyl)-3-[2-(4-hydroxyphenyl)ethyl]-2-[1-(4-hydroxyphenyl)-2-methoxy-2-oxidanylidene-ethyl]-5-oxidanyl-6H-pyrrolo[3,2-g]carbazol-7-yl] sulfate Openeye Name: sodium [5-hydroxy-1,4-bis(4-hydroxyphenyl)-3-[2-(4-hydroxyphenyl)ethyl]-2-[1-(4-hydroxyphenyl)-2-methoxy-2-oxo-ethyl]-6H-pyrrolo[3,2-g]carbazol-7-yl] sulfate CAS Name: sodium [5-hydroxy-1,4-bis(4-hydroxyphenyl)-3-[2-(4-hydroxyphenyl)ethyl]-2-[1-(4-hydroxyphenyl)-2-methoxy-2-oxoethyl]-6H-pyrrolo[3,2-g]carbazol-7-yl] sulfate IUPAC Name: sodium [5-hydroxy-1,4-bis(4-hydroxyphenyl)-3-[2-(4-hydroxyphenyl)ethyl]-2-[1-(4-hydroxyphenyl)-2-methoxy-2-oxoethyl]-6H-pyrrolo[3,2-g]carbazol-7-yl] sulfate Traditional Name: sodium [5-hydroxy-1,4-bis(4-hydroxyphenyl)-3-[2-(4-hydroxyphenyl)ethyl]-2-[1-(4-hydroxyphenyl)-2-keto-2-methoxy-ethyl]-6H-pyrrolo[3,2-g]carbazol-7-yl] sulfate Formula: C43H33N2NaO11S MolecularWeight: 808.78369

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)O)C2=C(C3=C4C5=C(C(=CC=C5)OS(=O)(=O)[O-])NC4=C(C(=C3N2CCC6=CC=C(C=C6)O)C7=CC=C(C=C7)O)O)C8=CC=C(C=C8)O.[Na+]

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)O)C2=C(C3=C4C5=C(C(=CC=C5)OS(=O)(=O)[O-])NC4=C(C(=C3N2CCC6=CC=C(C=C6)O)C7=CC=C(C=C7)O)O)C8=CC=C(C=C8)O.[Na+]

InChI

InChI=1S/C43H34N2O11S.Na/c1-55-43(51)35(26-11-19-30(49)20-12-26)40-33(24-7-15-28(47)16-8-24)37-36-31-3-2-4-32(56-57(52,53)54)38(31)44-39(36)42(50)34(25-9-17-29(48)18-10-25)41(37)45(40)22-21-23-5-13-27(46)14-6-23;/h2-20,35,44,46-50H,21-22H2,1H3,(H,52,53,54);/q;+1/p-1