Sodium (3β,5β,8α,9β,10α,12β,13α,14β,17α,20S)-3,12-dihydroxycholan-24-oate

More details:

• Systematic name

  Sodium (3beta,5beta,8alpha,9beta,10alpha,12beta,13alpha,14beta,17alpha,20S)-3,12-dihydroxycholan-24-oate

• SMILES

  [Na+].C[C@@H](CCC([O-])=O)[C@@H]1CC[C@@H]2[C@H]3CC[C@@H]4C[C@@H](O)CC[C@@]4(C)[C@@H]3C[C@@H](O)[C@]21C

• Std. InChi

  InChI=1S/C24H40O4.Na/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3;/h14-21,25-26H,4-13H2,1-3H3,(H,27,28);/q;+1/p-1/t14-,15+,16-,17+,18-,19+,20+,21+,23+,24-;/m0./s1

• Std. InChIKey

  FHHPUSMSKHSNKW-SUXOGFNFSA-M

• Cite this record

  CSID:114565961, http://www.chemspider.com/Chemical-Structure.114565961.html (accessed 13:36, May 16, 2024)