(8ξ,9ξ,17ξ)-3,7,12-Trihydroxycholan-24-oic acid

More details:

• Systematic name

  (8xi,9xi,17xi)-3,7,12-Trihydroxycholan-24-oic acid

• SMILES

  [H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@]12C)[C@H](C)CCC(O)=O C[C@H](CCC(O)=O)C1CC[C@@H]2[C@@H]3[C@@H](C[C@@H](O)[C@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O

• Std. InChi

  InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16?,17?,18?,19?,20?,22?,23+,24?/m1/s1

• Std. InChIKey

  BHQCQFFYRZLCQQ-MSAYVTHASA-N

• Cite this record

  CSID:74854254, http://www.chemspider.com/Chemical-Structure.74854254.html (accessed 05:06, Apr 20, 2024)