Molecule: 7alpha,12alpha,26-trihydroxycholest-4-en-3-one
A cholestanoid that is cholest-4-en-3-one which has been substituted by hydroxy groups at the 7alpha, 12alpha, and 26 positions. It is an intermediate in bile acid metabolism.
Synonyms for 7alpha,12alpha,26-trihydroxycholest-4-en-3-one :
4-cholesten-7alpha,12alpha,26-triol-3-one
4-cholesten-7alpha,12alpha,27-triol-3-one
Molecular Formula: C27H44O4
Molecular wt: 432.63586 g/mole
Charge: 0
SMILES: [H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)CC4=CC(=O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@]12C)[C@H](C)CCCC(C)CO
InChIKey: WOODKECARRKLJJ-DIJRFRLPSA-N
InChI=1S/C27H44O4/c1-16(15-28)6-5-7-17(2)20-8-9-21-25-22(14-24(31)27(20,21)4)26(3)11-10-19(29)12-18(26)13-23(25)30/h12,16-17,20-25,28,30-31H,5-11,13-15H2,1-4H3/t16?,17-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1