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Elsevier, Bioorganic and Medicinal Chemistry Letters, 7(11), p. 875-878

DOI: 10.1016/s0960-894x(01)00106-8

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Sodium etiobilirubin-IVγ-C10-sulfonate: A highly solvated bile pigment structure containing two different non-ridge-tile conformers in the unit cell

Journal article published in 2001 by Mathias O. Senge ORCID, Jin Shi, Jin Shi Ma, Antony F. McDonagh
This paper is available in a repository.
This paper is available in a repository.

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Abstract

The crystal structure of the title compound is the first example of a bilirubin existing in both extended and cyclic conformations and the first bile pigment structure showing two markedly different conformations in the unit cell. In contrast to previous rubin structures the dipyrrinone rings are twisted out of planarity in both conformers. Because of numerous hydrogen-bonding and ionic interactions a highly complex tetrameric structure is observed in which each extended conformer is held pincer-like by another.