(3α,5β,7α,8ξ)-3,7-Dihydroxycholestan-26-oic acid

More details:

• Systematic name

  (3alpha,5beta,7alpha,8xi)-3,7-Dihydroxycholestan-26-oic acid

• SMILES

  [H][C@@]1(CC[C@@]2([H])C3[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C(O)=O C[C@H](CCCC(C)C(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C

• Std. InChi

  InChI=1S/C27H46O4/c1-16(6-5-7-17(2)25(30)31)20-8-9-21-24-22(11-13-27(20,21)4)26(3)12-10-19(28)14-18(26)15-23(24)29/h16-24,28-29H,5-15H2,1-4H3,(H,30,31)/t16-,17?,18+,19-,20-,21+,22+,23-,24?,26+,27-/m1/s1

• Std. InChIKey

  ITZYGDKGRKKBSN-KLYSAGIUSA-N

• Cite this record

  CSID:59651433, http://www.chemspider.com/Chemical-Structure.59651433.html (accessed 16:04, Apr 18, 2024)