(+)-3-oxo-23,24-dinor-5α-cholan-22-oic acid:: Hydrogen-bonding patterns in a steroidal keto acid and its monohydrate

被引:31
作者
Lalancette, RA [1 ]
Thompson, HW [1 ]
Brunskill, APJ [1 ]
机构
[1] Rutgers State Univ, Dept Chem, Carl A Olson Mem Labs, Newark, NJ 07102 USA
关键词
D O I
10.1107/S0108270197016296
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The X-ray crystal structures of the title steroidal keto acid in both its anhydrous, C22H34O3, (I), and monohydrate, C22H34O3.H2O, (II), forms have been determined. Neither hydrogen-bonding pattern involves the ketone. Compound (I) forms infinite carboxyl-to-carboxyl hydrogen-bonding chains. This is the first observed case of a keto carboxylic acid forming such an acid-to-acid catemer, In (II), each carboxyl is hydrogen bonded to three water molecules and each water forms hydrogen bonds with carboxyl groups from three steroid molecules, creating a network of connected ten-membered hydrogen-bonding rings.
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页码:421 / 424
页数:4
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