(3α,5β,6α,7β,8ξ)-3,6,7-Trihydroxycholan-24-oic acid

More details:

• Systematic name

  (3alpha,5beta,6alpha,7beta,8xi)-3,6,7-Trihydroxycholan-24-oic acid

• SMILES

  C[C@H](CCC(O)=O)[C@H]1CC[C@H]2C3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1[C@@H](O)[C@@H]3O

• Std. InChi

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

• Std. InChIKey

  DKPMWHFRUGMUKF-AEAPBFKCSA-N

• Cite this record

  CSID:77498458, http://www.chemspider.com/Chemical-Structure.77498458.html (accessed 23:33, Mar 21, 2023)