1.0 2026-04-05 12:43:35 UTC 2026-05-14 18:17:19 UTC Obeticholic Acid SmallMolecule Obeticholic Acid is an organic compound with the formula C26H44O4 and an average molecular weight of 420.63 g/mol. Obeticholic Acid belongs to the bile acids, alcohols and derivatives, a subclass of steroids and steroid derivatives within the organic compounds. This compound is an agonist of the bile acid receptor (NR1H4). It is found in or released from two recorded sources: healthcare, pharmaceuticals & veterinary products used for bile therapy, and household cleaning & consumer products specifically categorized as non electric simulated smoking devices. The recorded route of exposure for this substance is oral. C26H44O4 420.634 420.3239599 459789-99-2 CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@H]([C@H](C)CCC(O)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CC[C@@H](O)C[C@@H]12 InChI=1S/C26H44O4/c1-5-17-21-14-16(27)10-12-26(21,4)20-11-13-25(3)18(15(2)6-9-22(28)29)7-8-19(25)23(20)24(17)30/h15-21,23-24,27,30H,5-14H2,1-4H3,(H,28,29)/t15-,16-,17-,18-,19+,20+,21+,23+,24-,25-,26-/m1/s1 ZXERDUOLZKYMJM-ZWECCWDJSA-N Detected and Not Quantified Obeticholic acid Drug Metabolism Action Pathway SMP0143983 logp 4.52 average_mass 420.634 ChemAxon mono_mass 420.3239599 ChemAxon smiles CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@H]([C@H](C)CCC(O)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CC[C@@H](O)C[C@@H]12 ChemAxon formula C26H44O4 ChemAxon inchi InChI=1S/C26H44O4/c1-5-17-21-14-16(27)10-12-26(21,4)20-11-13-25(3)18(15(2)6-9-22(28)29)7-8-19(25)23(20)24(17)30/h15-21,23-24,27,30H,5-14H2,1-4H3,(H,28,29)/t15-,16-,17-,18-,19+,20+,21+,23+,24-,25-,26-/m1/s1 ChemAxon inchikey ZXERDUOLZKYMJM-ZWECCWDJSA-N ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bf0e2b9a8> DB05990 447715 BE0001777