The crystal structure of baeocystin

The title compound, baeocystin or 4-phosphor­yloxy-N-methyl­tryptamine {systematic name: 3-[2-(methylazaniumyl)ethyl]-1H-indol-4-yl hydrogen phosphate}, C(11)H(15)N(2)O(4)P, has a single zwitterionic mol­ecule in the asymmetric unit. The mol­ecule has an intra­molecular N—H⋯O hydrogen bond between t...

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Detalles Bibliográficos
Autores principales: Naeem, Marilyn, Sherwood, Alexander M., Chadeayne, Andrew R., Golen, James A., Manke, David R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Research Communications
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9431787/
https://www.ncbi.nlm.nih.gov/pubmed/36072137
http://dx.doi.org/10.1107/S2056989022004467
Descripción
Sumario:The title compound, baeocystin or 4-phosphor­yloxy-N-methyl­tryptamine {systematic name: 3-[2-(methylazaniumyl)ethyl]-1H-indol-4-yl hydrogen phosphate}, C(11)H(15)N(2)O(4)P, has a single zwitterionic mol­ecule in the asymmetric unit. The mol­ecule has an intra­molecular N—H⋯O hydrogen bond between the ammonium cation and the hydro­phosphate anion. In the crystal, the mol­ecules are linked by N—H⋯O and O—H⋯O hydrogen bonds into a three-dimensional network.

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