N-Cholyl-L-Alanine

N-Cholyl-L-alanine is a bile acid amidate. It has been found in human fecal samples. Formal Name: N-[(3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxy-24-oxocholan-24-yl]-L-alanine. CAS Number: 18416-54-1. Synonyms: Alanocholic Acid N-Cholyl-Ala. Molecular Formula: C27H45NO6. Formula Weight: 479.7. Purity: >95%. Formulation (Request formulation change): A crystalline solid. Solubility: DMSO: Slightly soluble: 0.1-1 mg/ml Ethanol: Slightly soluble: 0.1-1 mg/ml. SMILES: C[C@H](CCC(N[C@@H](C)C(O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@@]21C. InChi Code: InChI=1S/C27H45NO6/c1-14(5-8-23(32)28-15(2)25(33)34)18-6-7-19-24-20(13-22(31)27(18,19)4)26(3)10-9-17(29)11-16(26)12-21(24)30/h14-22,24,29-31H,5-13H2,1-4H3,(H,28,32)(H,33,34)/t14-,15+,16+,17-,18-,19+,20+,21-,22+,24+,26+,27-/m1/s1. InChi Key: AZWGEBXBDOIOHW-OKVQJXITSA-N. Storage: -20°C. Stability: > 4 years.