(25R)-3β-hydroxycholest-5-en-7-one-26-oic acid

More details:

• Systematic name

  (3beta,25R)-3-Hydroxy-7-oxocholest-5-en-26-oic acid

• SMILES

  C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(C(C=C2C[C@H](C1)O)=O)[H])(CC[C@@]4([C@H](C)CCC[C@@H](C)C(O)=O)[H])[H])C)[H])C C[C@H](CCC[C@@H](C)C(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C=C4[C@@]3(CC[C@@H](C4)O)C)C

• Std. InChi

  InChI=1S/C27H42O4/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/h15-17,19-22,24,28H,5-14H2,1-4H3,(H,30,31)/t16-,17-,19+,20-,21+,22+,24+,26+,27-/m1/s1

• Std. InChIKey

  QOEPZHFZXUROGV-BXDHRDAUSA-N

• Cite this record

  CSID:58145642, http://www.chemspider.com/Chemical-Structure.58145642.html (accessed 00:56, Apr 27, 2024)